6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

C24H24F2N4O2S — CID 46940963

IUPAC6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
SMILESN#Cc1c(-c2ccc(S(=O)(=O)NC(CF)CF)cn2)n(CC2CC2)c2cc(C3CC3)ccc12
InChIInChI=1S/C24H24F2N4O2S/c25-10-18(11-26)29-33(31,32)19-6-8-22(28-13-19)24-21(12-27)20-7-5-17(16-3-4-16)9-23(20)30(24)14-15-1-2-15/h5-9,13,15-16,18,29H,1-4,10-11,14H2
InChIKeyAYJHUKIEQYQNGJ-UHFFFAOYSA-N
MW470.55 g/mol
LogP4.45
Rot. Bonds9

About 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (PubChem CID 46940963) has the molecular formula C24H24F2N4O2S and a molecular weight of 470.55 g/mol. Its IUPAC name is 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
PubChem CID46940963
Molecular FormulaC24H24F2N4O2S
Molecular Weight470.55 g/mol
Exact Mass470.16
IUPAC Name6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
SMILESN#Cc1c(-c2ccc(S(=O)(=O)NC(CF)CF)cn2)n(CC2CC2)c2cc(C3CC3)ccc12
InChIInChI=1S/C24H24F2N4O2S/c25-10-18(11-26)29-33(31,32)19-6-8-22(28-13-19)24-21(12-27)20-7-5-17(16-3-4-16)9-23(20)30(24)14-15-1-2-15/h5-9,13,15-16,18,29H,1-4,10-11,14H2
InChIKeyAYJHUKIEQYQNGJ-UHFFFAOYSA-N
XLogP4.45
TPSA87.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.55
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (CID 46940963) is 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is N#Cc1c(-c2ccc(S(=O)(=O)NC(CF)CF)cn2)n(CC2CC2)c2cc(C3CC3)ccc12.
What is the InChIKey of 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The InChIKey is AYJHUKIEQYQNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F2N4O2S/c25-10-18(11-26)29-33(31,32)19-6-8-22(28-13-19)24-21(12-27)20-7-5-17(16-3-4-16)9-23(20)30(24)14-15-1-2-15/h5-9,13,15-16,18,29H,1-4,10-11,14H2.
What are the key properties of 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 470.55 g/mol, XLogP of 4.45, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-cyano-6-cyclopropyl-1-(cyclopropylmethyl)indol-2-yl]-N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 46940963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).