(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide

C18H21N5O2 — CID 97305922

IUPAC(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESO=C1CCc2ccc(NC(=O)N3CCCC[C@@H]3c3cn[nH]c3)cc2N1
InChIInChI=1S/C18H21N5O2/c24-17-7-5-12-4-6-14(9-15(12)22-17)21-18(25)23-8-2-1-3-16(23)13-10-19-20-11-13/h4,6,9-11,16H,1-3,5,7-8H2,(H,19,20)(H,21,25)(H,22,24)/t16-/m1/s1
InChIKeyWZWZKGKWLJEWNW-MRXNPFEDSA-N
MW339.40 g/mol
LogP3.05
Rot. Bonds2

About (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide

(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide (PubChem CID 97305922) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
PubChem CID97305922
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESO=C1CCc2ccc(NC(=O)N3CCCC[C@@H]3c3cn[nH]c3)cc2N1
InChIInChI=1S/C18H21N5O2/c24-17-7-5-12-4-6-14(9-15(12)22-17)21-18(25)23-8-2-1-3-16(23)13-10-19-20-11-13/h4,6,9-11,16H,1-3,5,7-8H2,(H,19,20)(H,21,25)(H,22,24)/t16-/m1/s1
InChIKeyWZWZKGKWLJEWNW-MRXNPFEDSA-N
XLogP3.05
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(4aR,7aS)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine-1-carboxamide
CID 97048352
N-[3-(propanoylamino)phenyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 75521565
(2S)-N-(3-methyl-4-nitrophenyl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 99698277
(2S)-N-(1H-pyrazol-4-yl)-2-pyridin-4-ylazepane-1-carboxamide
CID 94661719
(2R)-N-(1H-pyrazol-4-yl)-2-pyridin-4-ylazepane-1-carboxamide
CID 94661720
N-(2-tert-butylpyrazol-3-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 154754412
(2R)-2-(1H-pyrazol-4-yl)-N-(pyridazin-3-ylmethyl)piperidine-1-carboxamide
CID 124721747
N-[2-(cyclopropylmethoxy)phenyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 75521633
N-[3-(2-methylpropanoylamino)propyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 75499708
(2R)-N-[[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 129382165
N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)piperidine-4-carboxamide;hydrochloride
CID 119326443
N-(3-phenylprop-2-ynyl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 84597437

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The IUPAC name of (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide (CID 97305922) is (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide is O=C1CCc2ccc(NC(=O)N3CCCC[C@@H]3c3cn[nH]c3)cc2N1.
What is the InChIKey of (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The InChIKey is WZWZKGKWLJEWNW-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H21N5O2/c24-17-7-5-12-4-6-14(9-15(12)22-17)21-18(25)23-8-2-1-3-16(23)13-10-19-20-11-13/h4,6,9-11,16H,1-3,5,7-8H2,(H,19,20)(H,21,25)(H,22,24)/t16-/m1/s1.
What are the key properties of (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
(2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 3.05, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 97305922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).