6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide

C10H14N2O3S — CID 122628419

IUPAC6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NS(=O)(=O)C(C)C)n1
InChIInChI=1S/C10H14N2O3S/c1-7(2)16(14,15)12-10(13)9-6-4-5-8(3)11-9/h4-7H,1-3H3,(H,12,13)
InChIKeySAXITVMMUMCMHT-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.86
Rot. Bonds3

About 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide

6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide (PubChem CID 122628419) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide
PubChem CID122628419
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)NS(=O)(=O)C(C)C)n1
InChIInChI=1S/C10H14N2O3S/c1-7(2)16(14,15)12-10(13)9-6-4-5-8(3)11-9/h4-7H,1-3H3,(H,12,13)
InChIKeySAXITVMMUMCMHT-UHFFFAOYSA-N
XLogP0.86
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloropropyl)-6-methylpyridine-2-carboxamide
CID 114296366
N-(3-bromobutan-2-yl)-6-methylpyridine-2-carboxamide
CID 131183457
6-methyl-N-(2-methyl-3-sulfamoylphenyl)pyridine-2-carboxamide
CID 61129334
N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide
CID 33045236
(2S)-2-methyl-3-[(6-methylpyridine-2-carbonyl)amino]propanoic acid
CID 94540901
N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide
CID 32696107
N-(1-bromo-4-methylpentan-3-yl)-6-methylpyridine-2-carboxamide
CID 106355356
N-(2-ethylbutyl)-6-methylpyridine-2-carboxamide
CID 115612957
N-[1-(4-methoxyphenyl)ethyl]-6-methylpyridine-2-carboxamide
CID 110462509
N-(2-chloro-4-methylpentyl)-6-methylpyridine-2-carboxamide
CID 107157522
6-methyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-2-carboxamide
CID 47151732
N-(4-amino-2-methylbutyl)-6-methylpyridine-2-carboxamide
CID 66089048

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide (CID 122628419) is 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide is Cc1cccc(C(=O)NS(=O)(=O)C(C)C)n1.
What is the InChIKey of 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide?
The InChIKey is SAXITVMMUMCMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-7(2)16(14,15)12-10(13)9-6-4-5-8(3)11-9/h4-7H,1-3H3,(H,12,13).
What are the key properties of 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide?
6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide has a molecular weight of 242.30 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propan-2-ylsulfonylpyridine-2-carboxamide is sourced from PubChem (CID 122628419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).