N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide

C12H21N5O3S — CID 167766806

IUPACN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide
SMILESCCc1c(NC(=O)C2CCN(S(N)(=O)=O)CC2)n[nH]c1C
InChIInChI=1S/C12H21N5O3S/c1-3-10-8(2)15-16-11(10)14-12(18)9-4-6-17(7-5-9)21(13,19)20/h9H,3-7H2,1-2H3,(H2,13,19,20)(H2,14,15,16,18)
InChIKeyXWLXVNRWUQOXHY-UHFFFAOYSA-N
MW315.40 g/mol
LogP0.13
Rot. Bonds4

About N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide

N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide (PubChem CID 167766806) has the molecular formula C12H21N5O3S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide
PubChem CID167766806
Molecular FormulaC12H21N5O3S
Molecular Weight315.40 g/mol
Exact Mass315.14
IUPAC NameN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide
SMILESCCc1c(NC(=O)C2CCN(S(N)(=O)=O)CC2)n[nH]c1C
InChIInChI=1S/C12H21N5O3S/c1-3-10-8(2)15-16-11(10)14-12(18)9-4-6-17(7-5-9)21(13,19)20/h9H,3-7H2,1-2H3,(H2,13,19,20)(H2,14,15,16,18)
InChIKeyXWLXVNRWUQOXHY-UHFFFAOYSA-N
XLogP0.13
TPSA121.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-1,3-thiazol-2-yl)-1-sulfamoylpiperidine-4-carboxamide
CID 47158637
1-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-3-(oxan-4-yl)urea
CID 167991927
N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-methylcyclohexane-1-carboxamide
CID 112692863
1-ethylsulfonyl-N-(3-methoxy-1H-1,2,4-triazol-5-yl)piperidine-4-carboxamide
CID 83090467
3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide
CID 112689240
N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide
CID 156585386
N-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]cyclobutanecarboxamide
CID 110823345
N-(2-methylpentan-3-yl)-1-sulfamoylpiperidine-4-carboxamide
CID 47418589
N-(3-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-sulfamoylpiperidine-4-carboxamide
CID 99812976
N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-4-sulfamoylpiperazine-1-carboxamide
CID 119069467
N-[(1S)-1-phenylbutyl]-1-sulfamoylpiperidine-4-carboxamide
CID 31977352
(3S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 104618674

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide?
The IUPAC name of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide (CID 167766806) is N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide is CCc1c(NC(=O)C2CCN(S(N)(=O)=O)CC2)n[nH]c1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide?
The InChIKey is XWLXVNRWUQOXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O3S/c1-3-10-8(2)15-16-11(10)14-12(18)9-4-6-17(7-5-9)21(13,19)20/h9H,3-7H2,1-2H3,(H2,13,19,20)(H2,14,15,16,18).
What are the key properties of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide?
N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide has a molecular weight of 315.40 g/mol, XLogP of 0.13, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-1-sulfamoylpiperidine-4-carboxamide is sourced from PubChem (CID 167766806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).