1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide

C18H24N4O — CID 48508171

IUPAC1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
SMILESCCc1cc(NC(=O)C2CCCN(Cc3ccccc3)C2)n[nH]1
InChIInChI=1S/C18H24N4O/c1-2-16-11-17(21-20-16)19-18(23)15-9-6-10-22(13-15)12-14-7-4-3-5-8-14/h3-5,7-8,11,15H,2,6,9-10,12-13H2,1H3,(H2,19,20,21,23)
InChIKeyFOLTVCQPEQKYQR-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.82
Rot. Bonds5

About 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide

1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide (PubChem CID 48508171) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
PubChem CID48508171
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
SMILESCCc1cc(NC(=O)C2CCCN(Cc3ccccc3)C2)n[nH]1
InChIInChI=1S/C18H24N4O/c1-2-16-11-17(21-20-16)19-18(23)15-9-6-10-22(13-15)12-14-7-4-3-5-8-14/h3-5,7-8,11,15H,2,6,9-10,12-13H2,1H3,(H2,19,20,21,23)
InChIKeyFOLTVCQPEQKYQR-UHFFFAOYSA-N
XLogP2.82
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-benzyl-N-(2-ethylphenyl)piperidine-3-carboxamide
CID 93490464
1-benzyl-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 60565468
N-(5-ethyl-1H-pyrazol-3-yl)-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 71991373
1-benzyl-N-methylpiperidine-3-carboxamide
CID 43918327
(3R)-1-benzyl-N-[3-(difluoromethyl)-5-methyl-1H-pyrazol-4-yl]piperidine-3-carboxamide
CID 124882392
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925060
(3R)-1-benzyl-N-(2-ethoxyphenyl)piperidine-3-carboxamide
CID 93490668
1-benzyl-N-(2-ethoxyphenyl)piperidine-3-carboxamide
CID 43919718
(3S)-1-benzyl-N-(2,6-dimethylphenyl)piperidine-3-carboxamide
CID 801756
(3S)-1-benzyl-N-(2-methylphenyl)piperidine-3-carboxamide
CID 93490302
1-benzyl-N-(2-chlorophenyl)piperidine-3-carboxamide
CID 43919369
1-benzyl-N-(2-hydroxyphenyl)piperidine-3-carboxamide
CID 60563080

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide (CID 48508171) is 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide is CCc1cc(NC(=O)C2CCCN(Cc3ccccc3)C2)n[nH]1.
What is the InChIKey of 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide?
The InChIKey is FOLTVCQPEQKYQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-2-16-11-17(21-20-16)19-18(23)15-9-6-10-22(13-15)12-14-7-4-3-5-8-14/h3-5,7-8,11,15H,2,6,9-10,12-13H2,1H3,(H2,19,20,21,23).
What are the key properties of 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide?
1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide has a molecular weight of 312.42 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide is sourced from PubChem (CID 48508171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).