6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide

C11H13N3O2S — CID 115602600

IUPAC6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NCC2CCC2)cn1
InChIInChI=1S/C11H13N3O2S/c12-6-10-4-5-11(8-13-10)17(15,16)14-7-9-2-1-3-9/h4-5,8-9,14H,1-3,7H2
InChIKeyTWTXZPLCUSTHAX-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.03
Rot. Bonds4

About 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide

6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide (PubChem CID 115602600) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
PubChem CID115602600
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NCC2CCC2)cn1
InChIInChI=1S/C11H13N3O2S/c12-6-10-4-5-11(8-13-10)17(15,16)14-7-9-2-1-3-9/h4-5,8-9,14H,1-3,7H2
InChIKeyTWTXZPLCUSTHAX-UHFFFAOYSA-N
XLogP1.03
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyano-N-[(4-ethylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 115602773
6-cyano-N-[(2-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107418699
6-cyano-N-(cyclobutylmethyl)-N-methylpyridine-3-sulfonamide
CID 115621452
6-cyano-N-cyclooctylpyridine-3-sulfonamide
CID 115602393
5-[[(6-cyano-3-pyridinyl)sulfonylamino]methyl]oxolane-2-carboxylic acid
CID 114612958
6-cyano-N-[3-(cyclopropylamino)propyl]pyridine-3-sulfonamide
CID 114614830
6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 115618854
6-cyano-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 115602590
6-cyano-N-propylpyridine-3-sulfonamide
CID 115602408
6-cyano-N-[(4-methylmorpholin-2-yl)methyl]pyridine-3-sulfonamide
CID 115602812
6-cyano-N-[(1-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 115754039
N-(2-chlorocyclohexyl)-6-cyanopyridine-3-sulfonamide
CID 106441981

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide (CID 115602600) is 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide is N#Cc1ccc(S(=O)(=O)NCC2CCC2)cn1.
What is the InChIKey of 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide?
The InChIKey is TWTXZPLCUSTHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c12-6-10-4-5-11(8-13-10)17(15,16)14-7-9-2-1-3-9/h4-5,8-9,14H,1-3,7H2.
What are the key properties of 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide?
6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide has a molecular weight of 251.31 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 115602600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).