N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide

C16H16N2OS — CID 79217122

IUPACN-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide
SMILESCSc1ccc(C(=O)Nc2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C16H16N2OS/c1-20-14-5-2-11(3-6-14)16(19)18-13-4-7-15-12(10-13)8-9-17-15/h2-7,10,17H,8-9H2,1H3,(H,18,19)
InChIKeyJVWKYGHRPLBMGM-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.63
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide

N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide (PubChem CID 79217122) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide
PubChem CID79217122
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC NameN-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide
SMILESCSc1ccc(C(=O)Nc2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C16H16N2OS/c1-20-14-5-2-11(3-6-14)16(19)18-13-4-7-15-12(10-13)8-9-17-15/h2-7,10,17H,8-9H2,1H3,(H,18,19)
InChIKeyJVWKYGHRPLBMGM-UHFFFAOYSA-N
XLogP3.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide 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

N-(2,3-dihydro-1H-indol-5-yl)-4-iodobenzamide
CID 63252905
N-(2,3-dihydro-1H-indol-5-yl)-3,4,5-trifluorobenzamide
CID 63252893
N-(3-bromo-4-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 63334695
N-(2,3-dihydro-1H-indol-5-yl)-3,4-diethoxybenzamide
CID 119473764
N-(2,3-dihydro-1H-indol-5-yl)-3-hydroxy-4-methoxybenzamide
CID 79735171
N-(2,3-dihydro-1H-indol-5-yl)-1,3-benzodioxole-5-carboxamide
CID 63252648
N-(2,3-dihydro-1H-indol-5-yl)pyridine-3-carboxamide
CID 63253121
3-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 55169715
N-(2,3-dihydro-1H-indol-5-yl)-2,4-dimethylbenzamide
CID 63252782
N-(1H-indazol-5-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43704644
N-(2,3-dihydro-1H-indol-5-yl)-2-fluoro-5-methylbenzamide
CID 63252982
N-[4-(2-hydroxyethyl)phenyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 61237345

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide (CID 79217122) is N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide is CSc1ccc(C(=O)Nc2ccc3c(c2)CCN3)cc1.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide?
The InChIKey is JVWKYGHRPLBMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2OS/c1-20-14-5-2-11(3-6-14)16(19)18-13-4-7-15-12(10-13)8-9-17-15/h2-7,10,17H,8-9H2,1H3,(H,18,19).
What are the key properties of N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide?
N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide has a molecular weight of 284.38 g/mol, XLogP of 3.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-yl)-4-methylsulfanylbenzamide is sourced from PubChem (CID 79217122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).