(1-Isopropylpiperidin-4-yl)methanol - CAS 280774-03-0

Catalog:	BB019763
Product Name:	(1-Isopropylpiperidin-4-yl)methanol
CAS:	280774-03-0
Synonyms:	(1-propan-2-ylpiperidin-4-yl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(1-propan-2-ylpiperidin-4-yl)methanol
Description:	(1-Isopropylpiperidin-4-yl)methanol (CAS# 280774-03-0) is a useful reagent in the synthesis of Histamine H3 receptor antagonist.
Molecular Weight:	157.25
Molecular Formula:	C9H19NO
Canonical SMILES:	CC(C)N1CCC(CC1)CO
InChI:	InChI=1S/C9H19NO/c1-8(2)10-5-3-9(7-11)4-6-10/h8-9,11H,3-7H2,1-2H3
InChI Key:	FLKOJXQVRBGEES-UHFFFAOYSA-N
Boiling Point:	223.2 °C at 760 mmHg
Density:	0.934 g/cm³
MDL:	MFCD08059811
LogP:	1.03700

Publication Number	Title	Priority Date
WO-2021105960-A1	Substituted tricyclic compounds	20191129
US-2021147385-A1	Compounds and methods for targeting pathogenic blood vessels	20191018
US-2021078996-A1	Hpk1 antagonists and uses thereof	20190913
US-2021078997-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROL[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913
US-2021078998-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913

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Complexity:	106
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:	2
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1