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

C16H20N4O — CID 166186970

IUPACN-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCCC(c2ccn[nH]2)C1
InChIInChI=1S/C16H20N4O/c21-16(17-11-13-5-2-1-3-6-13)20-10-4-7-14(12-20)15-8-9-18-19-15/h1-3,5-6,8-9,14H,4,7,10-12H2,(H,17,21)(H,18,19)
InChIKeyDPVXOVMFQWXFJA-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.50
Rot. Bonds3

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

N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide (PubChem CID 166186970) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
PubChem CID166186970
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCCC(c2ccn[nH]2)C1
InChIInChI=1S/C16H20N4O/c21-16(17-11-13-5-2-1-3-6-13)20-10-4-7-14(12-20)15-8-9-18-19-15/h1-3,5-6,8-9,14H,4,7,10-12H2,(H,17,21)(H,18,19)
InChIKeyDPVXOVMFQWXFJA-UHFFFAOYSA-N
XLogP2.50
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-imidazol-1-ylphenyl)methyl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 166197984
N-(4-phenylphenyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 166207366
2-(2-phenylethoxy)-1-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 95768623
N-benzyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104503
1-phenyl-4-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]butane-1,4-dione
CID 97080910
1-[3-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 62867071
cyclopropyl-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 62866717
3-(1H-pyrazol-5-yl)-N-[(1-thiophen-2-ylcyclohexyl)methyl]piperidine-1-carboxamide
CID 138998629
(3R)-N-benzyl-3-(2-oxoimidazolidin-1-yl)piperidine-1-carboxamide
CID 95047911
3-(1H-benzimidazol-2-yl)-N-benzylpiperidine-1-carboxamide
CID 42934572
1-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]-3-pyridin-3-ylpropan-1-one
CID 125012670
(3R)-N-[(2S)-2-methoxy-3,3-dimethylbutyl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 124615298

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The IUPAC name of N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide (CID 166186970) is N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The canonical SMILES for N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide is O=C(NCc1ccccc1)N1CCCC(c2ccn[nH]2)C1.
What is the InChIKey of N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The InChIKey is DPVXOVMFQWXFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c21-16(17-11-13-5-2-1-3-6-13)20-10-4-7-14(12-20)15-8-9-18-19-15/h1-3,5-6,8-9,14H,4,7,10-12H2,(H,17,21)(H,18,19).
What are the key properties of N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide is sourced from PubChem (CID 166186970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).