4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide

C18H24N4O2S — CID 75494864

IUPAC4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCn2ncnc21)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H24N4O2S/c23-25(24,21-17-7-4-12-22-18(17)19-13-20-22)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h8-11,13-14,17,21H,1-7,12H2
InChIKeyIGNIEYYZOKEBJQ-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.14
Rot. Bonds4

About 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide

4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide (PubChem CID 75494864) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
PubChem CID75494864
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC Name4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCn2ncnc21)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H24N4O2S/c23-25(24,21-17-7-4-12-22-18(17)19-13-20-22)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h8-11,13-14,17,21H,1-7,12H2
InChIKeyIGNIEYYZOKEBJQ-UHFFFAOYSA-N
XLogP3.14
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-acetyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-3,4-dihydro-2H-quinoline-7-sulfonamide
CID 128999323
N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-2,3-dihydro-1H-indene-2-sulfonamide
CID 128999300
2,5-dimethyl-3-methylsulfonyl-N-[(8S)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]benzenesulfonamide
CID 129471097
4-cyclohexyl-N-[(3S)-piperidin-3-yl]benzenesulfonamide
CID 120716650
1-(3-methylcyclohexyl)-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide
CID 138009395
4-cyclohexyl-N-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
CID 35539697
4-cyclohexyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119966752
4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960370
4-cyclohexyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzenesulfonamide
CID 25499358
N-(2-methylpropyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 115876715
2,2,3,3-tetramethyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)cyclopropane-1-carboxamide
CID 127433298
N-(4-cyclohexylphenyl)sulfonyl-1,5-dimethylpyrazole-4-carboxamide
CID 87011398

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide?
The IUPAC name of 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide (CID 75494864) is 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide.
What is the SMILES notation for 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide?
The canonical SMILES for 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide is O=S(=O)(NC1CCCn2ncnc21)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide?
The InChIKey is IGNIEYYZOKEBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c23-25(24,21-17-7-4-12-22-18(17)19-13-20-22)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h8-11,13-14,17,21H,1-7,12H2.
What are the key properties of 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide?
4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide has a molecular weight of 360.48 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide is sourced from PubChem (CID 75494864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).