1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide

C12H18N4O2 — CID 60973723

IUPAC1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2cc(C)[nH]n2)CC1
InChIInChI=1S/C12H18N4O2/c1-8-7-11(15-14-8)13-12(18)10-3-5-16(6-4-10)9(2)17/h7,10H,3-6H2,1-2H3,(H2,13,14,15,18)
InChIKeyQEUMPNZSPNWIJQ-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.92
Rot. Bonds2

About 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide

1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide (PubChem CID 60973723) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
PubChem CID60973723
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2cc(C)[nH]n2)CC1
InChIInChI=1S/C12H18N4O2/c1-8-7-11(15-14-8)13-12(18)10-3-5-16(6-4-10)9(2)17/h7,10H,3-6H2,1-2H3,(H2,13,14,15,18)
InChIKeyQEUMPNZSPNWIJQ-UHFFFAOYSA-N
XLogP0.92
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
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CID 84554290
1-acetyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide
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(3S)-N-(5-methyl-1H-pyrazol-3-yl)-1-pyridazin-3-ylpyrrolidine-3-carboxamide
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N-(5-methyl-1H-pyrazol-3-yl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107127185
1-acetyl-N-pyrimidin-2-ylpiperidine-4-carboxamide
CID 29367836
N-(5-propyl-1H-pyrazol-3-yl)cyclopropanecarboxamide
CID 115619791
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
N-(5-methyl-1H-pyrazol-3-yl)-1-(6-methylpyridazin-3-yl)piperidine-3-carboxamide
CID 121118676
1-acetyl-N-(5-fluoro-2-pyridinyl)piperidine-4-carboxamide
CID 163343949
N-(5-methyl-1H-pyrazol-3-yl)-1-pyrimidin-2-ylpyrrolidine-2-carboxamide
CID 63818386
1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)-4-propylpiperidine-4-carboxamide
CID 126487186

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide (CID 60973723) is 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)Nc2cc(C)[nH]n2)CC1.
What is the InChIKey of 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The InChIKey is QEUMPNZSPNWIJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-8-7-11(15-14-8)13-12(18)10-3-5-16(6-4-10)9(2)17/h7,10H,3-6H2,1-2H3,(H2,13,14,15,18).
What are the key properties of 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 60973723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).