1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide

C10H14N4O3 — CID 112513837

IUPAC1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cc(=O)[nH][nH]2)CC1
InChIInChI=1S/C10H14N4O3/c11-9(16)6-1-3-14(4-2-6)10(17)7-5-8(15)13-12-7/h5-6H,1-4H2,(H2,11,16)(H2,12,13,15)
InChIKeyUWJYBEOUWRJGMT-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.96
Rot. Bonds2

About 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide

1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide (PubChem CID 112513837) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide
PubChem CID112513837
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Name1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cc(=O)[nH][nH]2)CC1
InChIInChI=1S/C10H14N4O3/c11-9(16)6-1-3-14(4-2-6)10(17)7-5-8(15)13-12-7/h5-6H,1-4H2,(H2,11,16)(H2,12,13,15)
InChIKeyUWJYBEOUWRJGMT-UHFFFAOYSA-N
XLogP-0.96
TPSA112.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-fluoro-4-methylpiperidine-1-carbonyl)-2-methyl-1H-pyrazol-3-one
CID 154843440
N-methyl-5-oxo-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]-1,2-dihydropyrazole-3-carboxamide
CID 90224495
N-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 90226850
1-[2-(2-Oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
CID 63572420
1-[2-(3,6-dioxo-1H-pyridazin-2-yl)acetyl]piperidine-4-carbohydrazide
CID 63573551
1-[2-(2-Methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
CID 63577083
2-isobutyl-8-[(5-oxo-2,5-dihydro-1H-pyrazol-3-yl)carbonyl]-2,8-diazaspiro[4.5]decan-3-one
CID 72847204
5-(3,5-Dimethylpiperidine-1-carbonyl)-1,2-dihydropyrazol-3-one
CID 108466349
5-(2-Methylpiperidine-1-carbonyl)-1,2-dihydropyrazol-3-one
CID 108466356
N-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide
CID 108466392
5-(3-Methylpiperidine-1-carbonyl)-1,2-dihydropyrazol-3-one
CID 110600681
5-(Piperidine-1-carbonyl)-1,2-dihydropyrazol-3-one
CID 112513808

Frequently Asked Questions

What is the IUPAC name of 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide (CID 112513837) is 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)c2cc(=O)[nH][nH]2)CC1.
What is the InChIKey of 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is UWJYBEOUWRJGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c11-9(16)6-1-3-14(4-2-6)10(17)7-5-8(15)13-12-7/h5-6H,1-4H2,(H2,11,16)(H2,12,13,15).
What are the key properties of 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide?
1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide has a molecular weight of 238.25 g/mol, XLogP of -0.96, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-oxo-1,2-dihydropyrazole-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 112513837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).