N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide

C9H12N4O2 — CID 62490219

IUPACN-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide
SMILESO=C1CCC(NC(=O)c2ccn[nH]2)CN1
InChIInChI=1S/C9H12N4O2/c14-8-2-1-6(5-10-8)12-9(15)7-3-4-11-13-7/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13)(H,12,15)
InChIKeyZNOQSSNMVMJSRQ-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.58
Rot. Bonds2

About N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide

N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide (PubChem CID 62490219) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide
PubChem CID62490219
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC NameN-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide
SMILESO=C1CCC(NC(=O)c2ccn[nH]2)CN1
InChIInChI=1S/C9H12N4O2/c14-8-2-1-6(5-10-8)12-9(15)7-3-4-11-13-7/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13)(H,12,15)
InChIKeyZNOQSSNMVMJSRQ-UHFFFAOYSA-N
XLogP-0.58
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-4-yl-1H-pyrazole-5-carboxamide
CID 62050322
N-(azetidin-3-yl)-1H-pyrazole-5-carboxamide
CID 66187687
N-(6-oxopiperidin-3-yl)-1H-pyrrole-2-carboxamide
CID 62491246
N-[(3R)-piperidin-3-yl]-1H-pyrazole-5-carboxamide
CID 104645486
N-(6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 62492175
N-(6-oxopiperidin-3-yl)-1,2-oxazole-5-carboxamide
CID 63663681
N-(6-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 62492174
N-(6-oxopiperidin-3-yl)-2H-triazole-4-carboxamide
CID 78918284
methyl-[4-(1H-pyrazole-5-carbonylamino)piperidin-1-yl]borinic acid
CID 153412370
2,6-dichloro-N-(6-oxopiperidin-3-yl)benzamide
CID 55246624
3,6-dimethyl-2-[(6-oxopiperidin-3-yl)carbamoyl]benzoic acid
CID 103429074
(6-oxopiperidin-3-yl)carbamic acid
CID 77299994

Frequently Asked Questions

What is the IUPAC name of N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide (CID 62490219) is N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide is O=C1CCC(NC(=O)c2ccn[nH]2)CN1.
What is the InChIKey of N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is ZNOQSSNMVMJSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c14-8-2-1-6(5-10-8)12-9(15)7-3-4-11-13-7/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13)(H,12,15).
What are the key properties of N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide?
N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 208.22 g/mol, XLogP of -0.58, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxopiperidin-3-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 62490219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).