2-(piperidin-4-yloxy)pyrimidine - CAS 499240-48-1

Catalog:	BB026863
Product Name:	2-(piperidin-4-yloxy)pyrimidine
CAS:	499240-48-1
Synonyms:	2-(4-piperidinyloxy)pyrimidine; 2-piperidin-4-yloxypyrimidine

Technical Data

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Computed Properties

IUPAC Name:	2-piperidin-4-yloxypyrimidine
Description:	2-(piperidin-4-yloxy)pyrimidine (CAS# 499240-48-1) is a useful research chemical.
Molecular Weight:	179.22
Molecular Formula:	C9H13N3O
Canonical SMILES:	C1CNCCC1OC2=NC=CC=N2
InChI:	InChI=1S/C9H13N3O/c1-4-11-9(12-5-1)13-8-2-6-10-7-3-8/h1,4-5,8,10H,2-3,6-7H2
InChI Key:	IAFUZCLDORRBJY-UHFFFAOYSA-N
Boiling Point:	325.4 °C at 760 mmHg
Purity:	95 %
MDL:	MFCD05864743
LogP:	0.93620

Publication Number	Title	Priority Date
EP-3821947-A1	Heterocyclic trpml1 agonists	20191113
WO-2021094974-A1	Heterocyclic trpml1 agonists	20191113
EA-037208-B1	SUBSTITUTED PYRAZOLO [1,5-a] PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS	20170929
AU-2017342027-A1	Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors	20161010
EP-3523302-A1	Substituted pyrazolo[1,5-a]pyridine compounds as ret kinase inhibitors	20161010

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Related Functional Groups

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Ethyl 1-(methylsulfonyl)piperidine-4-carboxylate

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Complexity:	142
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.105862047
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	179.105862047
Rotatable Bond Count:	2
Topological Polar Surface Area:	47
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6