4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide

C23H22N2O4S — CID 135310019

IUPAC4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1ccc(-c2cccc3c2CCC3C(=O)NS(=O)(=O)c2ccccc2C)cn1
InChIInChI=1S/C23H22N2O4S/c1-15-6-3-4-9-21(15)30(27,28)25-23(26)20-12-11-19-17(7-5-8-18(19)20)16-10-13-22(29-2)24-14-16/h3-10,13-14,20H,11-12H2,1-2H3,(H,25,26)
InChIKeyYDGVDRZBGMRLCB-UHFFFAOYSA-N
MW422.51 g/mol
LogP3.60
Rot. Bonds5

About 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide

4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 135310019) has the molecular formula C23H22N2O4S and a molecular weight of 422.51 g/mol. Its IUPAC name is 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound Name4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID135310019
Molecular FormulaC23H22N2O4S
Molecular Weight422.51 g/mol
Exact Mass422.13
IUPAC Name4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1ccc(-c2cccc3c2CCC3C(=O)NS(=O)(=O)c2ccccc2C)cn1
InChIInChI=1S/C23H22N2O4S/c1-15-6-3-4-9-21(15)30(27,28)25-23(26)20-12-11-19-17(7-5-8-18(19)20)16-10-13-22(29-2)24-14-16/h3-10,13-14,20H,11-12H2,1-2H3,(H,25,26)
InChIKeyYDGVDRZBGMRLCB-UHFFFAOYSA-N
XLogP3.60
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.51
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 38029110
CID 38029110
CID 149566310
CID 149566310
CID 153337688
CID 153337688
CID 99123163
CID 99123163
CID 16071038
CID 16071038
CID 49832407
CID 49832407
CID 58291911
CID 58291911
CID 69051415
CID 69051415
CID 75298523
CID 75298523
CID 76743488
CID 76743488
CID 122664833
CID 122664833
CID 122664858
CID 122664858

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide (CID 135310019) is 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide is COc1ccc(-c2cccc3c2CCC3C(=O)NS(=O)(=O)c2ccccc2C)cn1.
What is the InChIKey of 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is YDGVDRZBGMRLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4S/c1-15-6-3-4-9-21(15)30(27,28)25-23(26)20-12-11-19-17(7-5-8-18(19)20)16-10-13-22(29-2)24-14-16/h3-10,13-14,20H,11-12H2,1-2H3,(H,25,26).
What are the key properties of 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide?
4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 422.51 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-3-pyridinyl)-N-(2-methylphenyl)sulfonyl-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 135310019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).