N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide

C10H14N4O2 — CID 112728864

IUPACN-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
SMILESCn1cc(NC(=O)C2CCC(=O)NC2)cn1
InChIInChI=1S/C10H14N4O2/c1-14-6-8(5-12-14)13-10(16)7-2-3-9(15)11-4-7/h5-7H,2-4H2,1H3,(H,11,15)(H,13,16)
InChIKeyULERLZSVMDIROO-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.12
Rot. Bonds2

About N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide

N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide (PubChem CID 112728864) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
PubChem CID112728864
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
SMILESCn1cc(NC(=O)C2CCC(=O)NC2)cn1
InChIInChI=1S/C10H14N4O2/c1-14-6-8(5-12-14)13-10(16)7-2-3-9(15)11-4-7/h5-7H,2-4H2,1H3,(H,11,15)(H,13,16)
InChIKeyULERLZSVMDIROO-UHFFFAOYSA-N
XLogP-0.12
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(6-oxopiperidine-3-carbonyl)amino]pyrazol-1-yl]acetic acid
CID 83192588
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-6-oxopiperidine-3-carboxamide
CID 112731492
1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 71897000
6-oxo-N-(2-piperidin-1-ylpyrimidin-5-yl)piperidine-3-carboxamide
CID 122298657
N-(4-tert-butylphenyl)-6-oxopiperidine-3-carboxamide
CID 78272138
5-[(6-oxopiperidine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 83192913
N-(3-bromo-5-methylphenyl)-6-oxopiperidine-3-carboxamide
CID 104938577
3-[(1-methylpyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782962
N-[4-(dimethylcarbamoyl)phenyl]-6-oxopiperidine-3-carboxamide
CID 112729111
(3S)-N-(3-tert-butyl-1-methylpyrazol-5-yl)-6-oxopiperidine-3-carboxamide
CID 95274619
N-(3,4-difluorophenyl)-6-oxopiperidine-3-carboxamide
CID 78594911
(3S)-N-(3,5-dichloro-4-methoxyphenyl)-6-oxopiperidine-3-carboxamide
CID 95279970

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide (CID 112728864) is N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide is Cn1cc(NC(=O)C2CCC(=O)NC2)cn1.
What is the InChIKey of N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide?
The InChIKey is ULERLZSVMDIROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-14-6-8(5-12-14)13-10(16)7-2-3-9(15)11-4-7/h5-7H,2-4H2,1H3,(H,11,15)(H,13,16).
What are the key properties of N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide?
N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 112728864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).