5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide

C17H15N3O2S — CID 22917300

IUPAC5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide
SMILESN#Cc1ccc(C2=C(c3ccc(S(N)(=O)=O)nc3)CCC2)cc1
InChIInChI=1S/C17H15N3O2S/c18-10-12-4-6-13(7-5-12)15-2-1-3-16(15)14-8-9-17(20-11-14)23(19,21)22/h4-9,11H,1-3H2,(H2,19,21,22)
InChIKeyGNTQZAAYXBIGJJ-UHFFFAOYSA-N
MW325.39 g/mol
LogP2.70
Rot. Bonds3

About 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide

5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide (PubChem CID 22917300) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide
PubChem CID22917300
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC Name5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide
SMILESN#Cc1ccc(C2=C(c3ccc(S(N)(=O)=O)nc3)CCC2)cc1
InChIInChI=1S/C17H15N3O2S/c18-10-12-4-6-13(7-5-12)15-2-1-3-16(15)14-8-9-17(20-11-14)23(19,21)22/h4-9,11H,1-3H2,(H2,19,21,22)
InChIKeyGNTQZAAYXBIGJJ-UHFFFAOYSA-N
XLogP2.70
TPSA96.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyanopyridine-2-sulfonamide
CID 22113934
4-[3-(6-methylsulfonyl-3-pyridinyl)spiro[4.4]non-2-en-2-yl]benzonitrile
CID 18933720
5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide
CID 22917315
4-[2-(6-chloro-5-fluoro-3-pyridinyl)cyclopenten-1-yl]benzenesulfonamide
CID 22917706
4-(2-formylcyclohepten-1-yl)benzonitrile
CID 71817020
4-[2-[6-chloro-5-(difluoromethyl)-3-pyridinyl]cyclopenten-1-yl]benzenesulfonamide
CID 22917255
[4-[7-(4-cyanophenyl)spiro[3.4]oct-6-en-6-yl]phenyl]methanesulfonamide
CID 139746258
5-chloropyridine-2-sulfonamide
CID 22244571
5-[2-(4-fluorophenyl)spiro[4.4]nona-1,3-dien-3-yl]pyridine-2-sulfonamide
CID 22907628
4-[2-(4-cyanophenyl)-1,3-thiazol-4-yl]benzenesulfonamide
CID 166436069
4-[4-(3-oxocyclohexen-1-yl)phenyl]benzonitrile
CID 102024731
5-[2-(4-methylsulfanylphenyl)spiro[4.4]nona-1,3-dien-3-yl]pyridine-2-sulfonamide
CID 22907476

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The IUPAC name of 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide (CID 22917300) is 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide.
What is the SMILES notation for 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The canonical SMILES for 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide is N#Cc1ccc(C2=C(c3ccc(S(N)(=O)=O)nc3)CCC2)cc1.
What is the InChIKey of 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The InChIKey is GNTQZAAYXBIGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c18-10-12-4-6-13(7-5-12)15-2-1-3-16(15)14-8-9-17(20-11-14)23(19,21)22/h4-9,11H,1-3H2,(H2,19,21,22).
What are the key properties of 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide has a molecular weight of 325.39 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide is sourced from PubChem (CID 22917300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).