4-(3-Hydroxypropyl)-1-methylpiperidine - CAS 7037-30-1

Catalog:	BB034140
Product Name:	4-(3-Hydroxypropyl)-1-methylpiperidine
CAS:	7037-30-1
Synonyms:	3-(1-methyl-4-piperidinyl)-1-propanol; 3-(1-methylpiperidin-4-yl)propan-1-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	3-(1-methylpiperidin-4-yl)propan-1-ol
Description:	4-(3-Hydroxypropyl)-1-methylpiperidine (CAS# 7037-30-1 ) is a useful research chemical.
Molecular Weight:	157.25
Molecular Formula:	C9H19NO
Canonical SMILES:	CN1CCC(CC1)CCCO
InChI:	InChI=1S/C9H19NO/c1-10-6-4-9(5-7-10)3-2-8-11/h9,11H,2-8H2,1H3
InChI Key:	QYRYQOHCDCTGHJ-UHFFFAOYSA-N
Boiling Point:	222.928 °C at 760 mmHg
Density:	0.941 g/cm³
LogP:	1.03860

Publication Number	Title	Priority Date
KR-20210093155-A	Novel compound, preparation method thereof, and use thereof	20200117
WO-2021145729-A1	Novel compound, preparation method thereof, and use thereof	20200117
WO-2021064188-A1	Combination comprising hdac inhibitor, ctla-4 inhibitor and a pd-1 inhibitor or pd-l1 inhibitor for cancer treatment	20191002
WO-2021043190-A1	Isoxazolo[5,4-h]quinazoline compounds as protein kinase inhibitors	20190905
WO-2021032935-A1	Enzyme inhibitors	20190821

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Complexity:	97.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	157.14666423
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	157.14666423
Rotatable Bond Count:	3
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1