4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide

C14H21N7O2S — CID 118266120

IUPAC4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1nccc(NCCC2CCCCC2)c1-c1nn[nH]n1
InChIInChI=1S/C14H21N7O2S/c15-24(22,23)14-12(13-18-20-21-19-13)11(7-9-17-14)16-8-6-10-4-2-1-3-5-10/h7,9-10H,1-6,8H2,(H,16,17)(H2,15,22,23)(H,18,19,20,21)
InChIKeyKUSIUUZQRHZIDM-UHFFFAOYSA-N
MW351.44 g/mol
LogP1.29
Rot. Bonds6

About 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide

4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide (PubChem CID 118266120) has the molecular formula C14H21N7O2S and a molecular weight of 351.44 g/mol. Its IUPAC name is 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
PubChem CID118266120
Molecular FormulaC14H21N7O2S
Molecular Weight351.44 g/mol
Exact Mass351.15
IUPAC Name4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1nccc(NCCC2CCCCC2)c1-c1nn[nH]n1
InChIInChI=1S/C14H21N7O2S/c15-24(22,23)14-12(13-18-20-21-19-13)11(7-9-17-14)16-8-6-10-4-2-1-3-5-10/h7,9-10H,1-6,8H2,(H,16,17)(H2,15,22,23)(H,18,19,20,21)
InChIKeyKUSIUUZQRHZIDM-UHFFFAOYSA-N
XLogP1.29
TPSA139.54 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.44
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

CID 118265917
CID 118265917
4-(3,9-diazaspiro[5.5]undecan-3-yl)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118256754
3-(1H-Tetrazol-5-yl)-4-(p-tolyl)pyridine-2-sulfonamide
CID 118256913
3''-(1H-tetrazol-5-yl)-[3,4''-bipyridine]-2''-sulfonamide
CID 118265336
3-(1H-tetrazol-5-yl)-[4,4''-bipyridine]-2-sulfonamide
CID 118265339
4-[cyclohexyl(methyl)amino]-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266065
4-(cyclohexylamino)-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266067
4-[4-(1-hydroxyethyl)piperidin-1-yl]-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266079
4-[4-(pyridin-4-ylmethyl)piperidin-1-yl]-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266093
4-(4-hydroxypiperidin-1-yl)-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266125
4-(4-pyrrolidin-1-ylpiperidin-1-yl)-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266151
4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-3-(1H-tetrazol-5-yl)pyridine-2-sulfonamide
CID 118266158

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The IUPAC name of 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide (CID 118266120) is 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The canonical SMILES for 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide is NS(=O)(=O)c1nccc(NCCC2CCCCC2)c1-c1nn[nH]n1.
What is the InChIKey of 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
The InChIKey is KUSIUUZQRHZIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N7O2S/c15-24(22,23)14-12(13-18-20-21-19-13)11(7-9-17-14)16-8-6-10-4-2-1-3-5-10/h7,9-10H,1-6,8H2,(H,16,17)(H2,15,22,23)(H,18,19,20,21).
What are the key properties of 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide?
4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide has a molecular weight of 351.44 g/mol, XLogP of 1.29, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclohexylethylamino)-3-(2H-tetrazol-5-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 118266120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).