3-Chloro-2-(1-piperidinyl)aniline - CAS 58785-06-1

Catalog:	BB030162
Product Name:	3-Chloro-2-(1-piperidinyl)aniline
CAS:	58785-06-1
Synonyms:	3-chloro-2-(1-piperidinyl)aniline; 3-chloro-2-piperidin-1-ylaniline

Technical Data

Patents

Computed Properties

IUPAC Name:	3-chloro-2-piperidin-1-ylaniline
Description:	3-Chloro-2-(1-piperidinyl)aniline (CAS# 58785-06-1) is a useful research chemical.
Molecular Weight:	210.70
Molecular Formula:	C11H15ClN2
Canonical SMILES:	C1CCN(CC1)C2=C(C=CC=C2Cl)N
InChI:	InChI=1S/C11H15ClN2/c12-9-5-4-6-10(13)11(9)14-7-2-1-3-8-14/h4-6H,1-3,7-8,13H2
InChI Key:	QKXQIYIXTYLFFD-UHFFFAOYSA-N
Boiling Point:	345.1 °C at 760 mmHg
Density:	1.197 g/cm³
MDL:	MFCD04971011
LogP:	3.55870

Publication Number	Title	Priority Date
WO-2021127337-A1	Trpml modulators	20191219
WO-2021041866-A1	Small molecule agonists of mucolipin 1 and uses thereof	20190830
AU-2005299476-A1	c-fms kinase inhibitors	20041022
EP-1812425-A2	C-fms kinase inhibitors	20041022
JP-2008517942-A	Inhibitor of C-FMS kinase	20041022

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Complexity:	180
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.0923762
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	210.0923762
Rotatable Bond Count:	1
Topological Polar Surface Area:	29.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8