5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide

C21H28N4O — CID 110268851

IUPAC5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide
SMILESO=C(NC1CCCC1)c1cc(C2CCCCN2Cc2ccccc2)[nH]n1
InChIInChI=1S/C21H28N4O/c26-21(22-17-10-4-5-11-17)19-14-18(23-24-19)20-12-6-7-13-25(20)15-16-8-2-1-3-9-16/h1-3,8-9,14,17,20H,4-7,10-13,15H2,(H,22,26)(H,23,24)
InChIKeyLARPRCYYKBBJQR-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.81
Rot. Bonds5

About 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide

5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide (PubChem CID 110268851) has the molecular formula C21H28N4O and a molecular weight of 352.48 g/mol. Its IUPAC name is 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide
PubChem CID110268851
Molecular FormulaC21H28N4O
Molecular Weight352.48 g/mol
Exact Mass352.23
IUPAC Name5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide
SMILESO=C(NC1CCCC1)c1cc(C2CCCCN2Cc2ccccc2)[nH]n1
InChIInChI=1S/C21H28N4O/c26-21(22-17-10-4-5-11-17)19-14-18(23-24-19)20-12-6-7-13-25(20)15-16-8-2-1-3-9-16/h1-3,8-9,14,17,20H,4-7,10-13,15H2,(H,22,26)(H,23,24)
InChIKeyLARPRCYYKBBJQR-UHFFFAOYSA-N
XLogP3.81
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-5-[(2S)-1-(3-phenylpropyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 95840522
N-cyclopentyl-5-[1-[3-(4-fluorophenyl)propanoyl]piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 110268965
N-cyclopropyl-5-(1-methylpyrrolidin-2-yl)-1H-pyrazole-3-carboxamide
CID 166252601
N-cyclopentyl-5-[1-(pyridine-3-carbonyl)piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 110268878
N-cyclopentyl-5-[1-[2-(4-methoxyphenyl)acetyl]piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 110268950
[5-[(2S)-1-[(4-fluorophenyl)methyl]piperidin-2-yl]-1H-pyrazol-3-yl]-morpholin-4-ylmethanone
CID 95840424
morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
CID 95840395
morpholin-4-yl-[5-[(2S)-1-(3-phenylpropyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
CID 95840524
5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide
CID 109182201
sodium 2-[4-[[2-(1-benzylpiperidin-2-yl)benzoyl]amino]piperidin-1-yl]acetate
CID 139889755
N-cyclopentyl-5-[(2S)-1-[3-(2,6-dioxo-1,3-diazinan-1-yl)propanoyl]piperidin-2-yl]-1H-pyrazole-3-carboxamide
CID 124978722
2-(4-benzylpiperazin-1-yl)-N-cyclopentyl-6-methylpyrimidine-4-carboxamide
CID 109322138

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide (CID 110268851) is 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide is O=C(NC1CCCC1)c1cc(C2CCCCN2Cc2ccccc2)[nH]n1.
What is the InChIKey of 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide?
The InChIKey is LARPRCYYKBBJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O/c26-21(22-17-10-4-5-11-17)19-14-18(23-24-19)20-12-6-7-13-25(20)15-16-8-2-1-3-9-16/h1-3,8-9,14,17,20H,4-7,10-13,15H2,(H,22,26)(H,23,24).
What are the key properties of 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide?
5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide has a molecular weight of 352.48 g/mol, XLogP of 3.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 110268851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).