(R)-1-(Tetrahydro-2H-pyran-4-yl)ethanamine - CAS 1269755-01-2

Catalog:	BB056866
Product Name:	(R)-1-(Tetrahydro-2H-pyran-4-yl)ethanamine
CAS:	1269755-01-2
Synonyms:	(αR)-Tetrahydro-α-methyl-2H-pyran-4-methanamine

Technical Data

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Computed Properties

IUPAC Name:	(1R)-1-(oxan-4-yl)ethanamine
Description:	(R)-1-(Tetrahydro-2H-pyran-4-yl)ethanamine is used in the prepartion of novel 3-quinoline carboxamides as potent, selective and orally bioavailable inhibitors of Ataxia Telangiectasia Mutated (ATM) Kinase.
Molecular Weight:	129.2
Molecular Formula:	C7H15NO
Canonical SMILES:	CC(C1CCOCC1)N
InChI:	InChI=1S/C7H15NO/c1-6(8)7-2-4-9-5-3-7/h6-7H,2-5,8H2,1H3/t6-/m1/s1
InChI Key:	WMPAKQDIADKRAQ-ZCFIWIBFSA-N
References:	Degorce, Sebastien L., et al. J Med Chem., 59, 628 (2016).

Publication Number	Title	Priority Date
CA-3017035-A1	Cinnolin-4-amine compounds and their use in treating cancer	20160321
JP-2019512512-A	Cinnolin-4-amine compounds and their use in cancer treatment	20160321
KR-20180127419-A	Cinnolin-4-amine compounds and uses thereof for treating cancer	20160321
US-2019099421-A1	Cinnolin-4-amine compounds and their use in treating cancer	20160321
EP-3168219-A1	Pyridone derivative having tetrahydropyranyl methyl group	20140707
US-10442797-B2	Pyridone derivatives having tetrahydropyranylmethyl groups	20140707
US-2017183329-A1	Pyridone derivative having tetrahydropyranylmethyl group	20140707
US-2018148436-A2	Pyridone derivatives having tetrahydropyranylmethyl groups	20140707
US-2020010458-A1	Pyridone derivatives having tetrahydropyranylmethyl groups	20140707
EP-3168219-B1	Pyridone derivative having tetrahydropyranyl methyl group	20140707

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	79
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	129.115364102
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	129.115364102
Rotatable Bond Count:	1
Topological Polar Surface Area:	35.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3