N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride

C16H27ClN4O — CID 119329584

IUPACN-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cc(C2CCCCCC2)[nH]n1)C1CCNCC1
InChIInChI=1S/C16H26N4O.ClH/c21-16(13-7-9-17-10-8-13)18-15-11-14(19-20-15)12-5-3-1-2-4-6-12;/h11-13,17H,1-10H2,(H2,18,19,20,21);1H
InChIKeyJJQHXYXPPQDKCK-UHFFFAOYSA-N
MW326.87 g/mol
LogP3.21
Rot. Bonds3

About N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride

N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride (PubChem CID 119329584) has the molecular formula C16H27ClN4O and a molecular weight of 326.87 g/mol. Its IUPAC name is N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
PubChem CID119329584
Molecular FormulaC16H27ClN4O
Molecular Weight326.87 g/mol
Exact Mass326.19
IUPAC NameN-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cc(C2CCCCCC2)[nH]n1)C1CCNCC1
InChIInChI=1S/C16H26N4O.ClH/c21-16(13-7-9-17-10-8-13)18-15-11-14(19-20-15)12-5-3-1-2-4-6-12;/h11-13,17H,1-10H2,(H2,18,19,20,21);1H
InChIKeyJJQHXYXPPQDKCK-UHFFFAOYSA-N
XLogP3.21
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.87
LogP ≤ 53.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 119329603
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CID 119794227
(2R,3S)-N-(5-cycloheptyl-1H-pyrazol-3-yl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120933939
N-(5-cycloheptyl-1H-pyrazol-3-yl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
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N-(5-cycloheptyl-1H-pyrazol-3-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 167960321
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
(2S)-2-amino-N-(5-cycloheptyl-1H-pyrazol-3-yl)-4-methylpentanamide;hydrochloride
CID 119794268
(4R)-N-(5-cyclopropyl-1H-pyrazol-3-yl)-1-methyl-2-oxo-3-piperidin-4-ylimidazolidine-4-carboxamide
CID 59534379
N-(3-cyclohexyl-1-methylpyrazol-5-yl)piperidine-4-carboxamide
CID 119337707
N-(5-cyclopentyl-1H-pyrazol-3-yl)-6-methylpyridine-3-carboxamide
CID 174055179
N-(5-cyclohexyl-1H-pyrazol-3-yl)-2-(4-hydroxycyclohexyl)-2-methylpropanamide
CID 128766710
1-(4-acetylphenyl)sulfonyl-N-(5-cyclopentyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride (CID 119329584) is N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride is Cl.O=C(Nc1cc(C2CCCCCC2)[nH]n1)C1CCNCC1.
What is the InChIKey of N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is JJQHXYXPPQDKCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O.ClH/c21-16(13-7-9-17-10-8-13)18-15-11-14(19-20-15)12-5-3-1-2-4-6-12;/h11-13,17H,1-10H2,(H2,18,19,20,21);1H.
What are the key properties of N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride?
N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 326.87 g/mol, XLogP of 3.21, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119329584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).