N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide

C23H19ClN2O2 — CID 109057097

IUPACN-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESCc1c(Cl)cccc1NC(=O)c1cccc(C(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C23H19ClN2O2/c1-15-19(24)9-5-10-20(15)25-22(27)17-7-4-8-18(14-17)23(28)26-13-12-16-6-2-3-11-21(16)26/h2-11,14H,12-13H2,1H3,(H,25,27)
InChIKeyDJAPMVHPXRIZNW-UHFFFAOYSA-N
MW390.87 g/mol
LogP5.10
Rot. Bonds3

About N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide

N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide (PubChem CID 109057097) has the molecular formula C23H19ClN2O2 and a molecular weight of 390.87 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
PubChem CID109057097
Molecular FormulaC23H19ClN2O2
Molecular Weight390.87 g/mol
Exact Mass390.11
IUPAC NameN-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESCc1c(Cl)cccc1NC(=O)c1cccc(C(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C23H19ClN2O2/c1-15-19(24)9-5-10-20(15)25-22(27)17-7-4-8-18(14-17)23(28)26-13-12-16-6-2-3-11-21(16)26/h2-11,14H,12-13H2,1H3,(H,25,27)
InChIKeyDJAPMVHPXRIZNW-UHFFFAOYSA-N
XLogP5.10
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.87
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-5-(2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108144
N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109057111
3-(2,3-dihydroindole-1-carbonyl)-N-(2-methoxy-5-methylphenyl)benzamide
CID 109057107
N-(5-chloro-2-methylphenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049544
3-(2,3-dihydroindole-1-carbonyl)benzoic acid
CID 43452867
N-(3-chloro-2-methylphenyl)-3-(4-formylpiperazine-1-carbonyl)benzamide
CID 109053818
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]acetamide
CID 26290520
N-tert-butyl-3-(3,4-dihydro-2H-quinoline-1-carbonyl)benzamide
CID 109055995
N-(3-chloro-2-methylphenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)pyrimidine-5-carboxamide
CID 109266318
4-(2,3-dihydroindole-1-carbonyl)-N-(2,4-dimethylphenyl)benzamide
CID 109049527
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
CID 109057134
N-(3-chloro-2-methylphenyl)-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
CID 1085733

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide (CID 109057097) is N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide is Cc1c(Cl)cccc1NC(=O)c1cccc(C(=O)N2CCc3ccccc32)c1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The InChIKey is DJAPMVHPXRIZNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN2O2/c1-15-19(24)9-5-10-20(15)25-22(27)17-7-4-8-18(14-17)23(28)26-13-12-16-6-2-3-11-21(16)26/h2-11,14H,12-13H2,1H3,(H,25,27).
What are the key properties of N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide has a molecular weight of 390.87 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide is sourced from PubChem (CID 109057097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).