1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide

C18H18N2O — CID 7329101

IUPAC1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)cc1
InChIInChI=1S/C18H18N2O/c1-12-4-7-15(8-5-12)19-18(21)17-11-14-10-13(2)6-9-16(14)20(17)3/h4-11H,1-3H3,(H,19,21)
InChIKeyXYCYNHVAQMJWLA-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.05
Rot. Bonds2

About 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide

1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide (PubChem CID 7329101) has the molecular formula C18H18N2O and a molecular weight of 278.35 g/mol. Its IUPAC name is 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide
PubChem CID7329101
Molecular FormulaC18H18N2O
Molecular Weight278.35 g/mol
Exact Mass278.14
IUPAC Name1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)cc1
InChIInChI=1S/C18H18N2O/c1-12-4-7-15(8-5-12)19-18(21)17-11-14-10-13(2)6-9-16(14)20(17)3/h4-11H,1-3H3,(H,19,21)
InChIKeyXYCYNHVAQMJWLA-UHFFFAOYSA-N
XLogP4.05
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[2-chloro-4-(2-oxoethyl)phenoxy]phenyl]-1,5-dimethylindole-2-carboxamide
CID 143840559
N-butyl-1,5-dimethylindole-2-carboxamide
CID 7329072
5-methoxy-1-methyl-N-phenylindole-2-carboxamide
CID 10707870
1-methyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamoyl]indole-5-carboxylic acid
CID 58408799
1,5-dimethyl-N-pyrrolidin-1-ylsulfonylindole-2-carboxamide
CID 118100925
7-fluoro-2-methyl-N-(4-methylphenyl)-1-oxoisoquinoline-3-carboxamide
CID 172904623
N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-1,5-dimethylindole-2-carboxamide
CID 46951674
5-ethyl-1-methyl-N-(4-methylphenyl)-4-oxopyrrolo[3,2-c]pyridine-2-carboxamide
CID 53134440
2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]acetic acid
CID 4967330
(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone
CID 7329070
1-methyl-3-N,5-N-bis(4-methylphenyl)pyrazole-3,5-dicarboxamide
CID 679026
5-fluoro-N-(1H-indol-6-yl)-1-methylindole-2-carboxamide
CID 90489194

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide?
The IUPAC name of 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide (CID 7329101) is 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide is Cc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)cc1.
What is the InChIKey of 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide?
The InChIKey is XYCYNHVAQMJWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-12-4-7-15(8-5-12)19-18(21)17-11-14-10-13(2)6-9-16(14)20(17)3/h4-11H,1-3H3,(H,19,21).
What are the key properties of 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide?
1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide is sourced from PubChem (CID 7329101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).