6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide

C10H14N4O2 — CID 112731393

IUPAC6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
SMILESO=C1CCC(C(=O)NCc2ccn[nH]2)CN1
InChIInChI=1S/C10H14N4O2/c15-9-2-1-7(5-11-9)10(16)12-6-8-3-4-13-14-8/h3-4,7H,1-2,5-6H2,(H,11,15)(H,12,16)(H,13,14)
InChIKeyZIPWEFIHJQXBHT-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.45
Rot. Bonds3

About 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide

6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide (PubChem CID 112731393) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
PubChem CID112731393
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
SMILESO=C1CCC(C(=O)NCc2ccn[nH]2)CN1
InChIInChI=1S/C10H14N4O2/c15-9-2-1-7(5-11-9)10(16)12-6-8-3-4-13-14-8/h3-4,7H,1-2,5-6H2,(H,11,15)(H,12,16)(H,13,14)
InChIKeyZIPWEFIHJQXBHT-UHFFFAOYSA-N
XLogP-0.45
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-oxo-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 78983105
(3S)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 94916818
1-methyl-5-oxo-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 61218006
1-acetyl-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide
CID 60976301
N-[(6-methyl-3-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 113223600
N-[(2-methylpyrazol-3-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 113223533
2-methyl-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide
CID 106739789
N-[(3-ethyl-2-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 82748805
N-[(3-chlorophenyl)methyl]-6-oxopiperidine-3-carboxamide
CID 112728690
(3S)-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-3-ylmethyl)-6-oxopiperidine-3-carboxamide
CID 126443586
N-(2-methylprop-2-enyl)-6-oxopiperidine-3-carboxamide
CID 114618525
N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide
CID 78924914

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide (CID 112731393) is 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide is O=C1CCC(C(=O)NCc2ccn[nH]2)CN1.
What is the InChIKey of 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide?
The InChIKey is ZIPWEFIHJQXBHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c15-9-2-1-7(5-11-9)10(16)12-6-8-3-4-13-14-8/h3-4,7H,1-2,5-6H2,(H,11,15)(H,12,16)(H,13,14).
What are the key properties of 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide?
6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 112731393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).