2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide

C18H20N2O — CID 71854820

IUPAC2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide
SMILESCc1ccc(C(=O)Nc2cccc3c2CCN3C)c(C)c1
InChIInChI=1S/C18H20N2O/c1-12-7-8-14(13(2)11-12)18(21)19-16-5-4-6-17-15(16)9-10-20(17)3/h4-8,11H,9-10H2,1-3H3,(H,19,21)
InChIKeyLWTHNFMQLLMWTR-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.55
Rot. Bonds2

About 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide

2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide (PubChem CID 71854820) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide
PubChem CID71854820
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide
SMILESCc1ccc(C(=O)Nc2cccc3c2CCN3C)c(C)c1
InChIInChI=1S/C18H20N2O/c1-12-7-8-14(13(2)11-12)18(21)19-16-5-4-6-17-15(16)9-10-20(17)3/h4-8,11H,9-10H2,1-3H3,(H,19,21)
InChIKeyLWTHNFMQLLMWTR-UHFFFAOYSA-N
XLogP3.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)benzamide
CID 43808455
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221
N-(5-carbamoyl-2-pyrrolidin-1-ylphenyl)-2,4-dimethylbenzamide
CID 30218966
N-[2-(aminomethyl)phenyl]-2,4-dimethylbenzamide
CID 16772806
N-(1,3-dioxoisoindol-4-yl)-2,4-dimethylbenzamide
CID 2086901
N-(2-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
N-[2-(difluoromethylsulfanyl)phenyl]-2,4-dimethylbenzamide
CID 34737714
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2,4-dimethylbenzamide
CID 34734992
N-(4-bromo-2-methylphenyl)-2,4-dimethylbenzamide
CID 953255
4-(2,3-dihydroindole-1-carbonyl)-N-(2,4-dimethylphenyl)benzamide
CID 109049527
N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide
CID 100720174
N-(4-benzamido-3-methylphenyl)-2,4-dimethylbenzamide
CID 1288920

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide?
The IUPAC name of 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide (CID 71854820) is 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide.
What is the SMILES notation for 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide?
The canonical SMILES for 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide is Cc1ccc(C(=O)Nc2cccc3c2CCN3C)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide?
The InChIKey is LWTHNFMQLLMWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-7-8-14(13(2)11-12)18(21)19-16-5-4-6-17-15(16)9-10-20(17)3/h4-8,11H,9-10H2,1-3H3,(H,19,21).
What are the key properties of 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide?
2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(1-methyl-2,3-dihydroindol-4-yl)benzamide is sourced from PubChem (CID 71854820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).