(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride

C15H18ClN3OS — CID 119399855

IUPAC(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(-c2nccs2)c1)[C@H]1CCCCN1
InChIInChI=1S/C15H17N3OS.ClH/c19-14(13-6-1-2-7-16-13)18-12-5-3-4-11(10-12)15-17-8-9-20-15;/h3-5,8-10,13,16H,1-2,6-7H2,(H,18,19);1H/t13-;/m1./s1
InChIKeyFAIKDWALXPFHDO-BTQNPOSSSA-N
MW323.85 g/mol
LogP3.31
Rot. Bonds3

About (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride

(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride (PubChem CID 119399855) has the molecular formula C15H18ClN3OS and a molecular weight of 323.85 g/mol. Its IUPAC name is (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride
PubChem CID119399855
Molecular FormulaC15H18ClN3OS
Molecular Weight323.85 g/mol
Exact Mass323.09
IUPAC Name(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(-c2nccs2)c1)[C@H]1CCCCN1
InChIInChI=1S/C15H17N3OS.ClH/c19-14(13-6-1-2-7-16-13)18-12-5-3-4-11(10-12)15-17-8-9-20-15;/h3-5,8-10,13,16H,1-2,6-7H2,(H,18,19);1H/t13-;/m1./s1
InChIKeyFAIKDWALXPFHDO-BTQNPOSSSA-N
XLogP3.31
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.85
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[4-(1,3-thiazol-2-yl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119269600
N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119164418
N-[3-(2-methylpyrimidin-4-yl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119280479
N-[3-(1H-pyrazol-5-yl)phenyl]azepane-2-carboxamide
CID 64563413
(2R)-N-(3-chlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 119671014
N-[3-(2H-tetrazol-5-yl)phenyl]piperidine-2-carboxamide
CID 43712968
(2R)-N-pyridin-4-ylpiperidine-2-carboxamide;dihydrochloride
CID 119827101
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119270940
(2S)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119270942
(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
1-acetyl-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-4-carboxamide
CID 51090657
N-(3-bromophenyl)piperidine-2-carboxamide
CID 18073202

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride (CID 119399855) is (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride is Cl.O=C(Nc1cccc(-c2nccs2)c1)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride?
The InChIKey is FAIKDWALXPFHDO-BTQNPOSSSA-N. The full InChI is InChI=1S/C15H17N3OS.ClH/c19-14(13-6-1-2-7-16-13)18-12-5-3-4-11(10-12)15-17-8-9-20-15;/h3-5,8-10,13,16H,1-2,6-7H2,(H,18,19);1H/t13-;/m1./s1.
What are the key properties of (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride?
(2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride has a molecular weight of 323.85 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[3-(1,3-thiazol-2-yl)phenyl]piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119399855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).