N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide

C18H18N2O — CID 60773719

IUPACN-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C18H18N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-8-7-14-9-10-19-16(14)11-15/h4-11,19H,3H2,1-2H3,(H,20,21)
InChIKeyRNEGQBCCDSXQKN-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.29
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide

N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide (PubChem CID 60773719) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
PubChem CID60773719
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C18H18N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-8-7-14-9-10-19-16(14)11-15/h4-11,19H,3H2,1-2H3,(H,20,21)
InChIKeyRNEGQBCCDSXQKN-UHFFFAOYSA-N
XLogP4.29
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide
CID 66255832
N-(2-ethyl-6-methylphenyl)-1H-indazole-5-carboxamide
CID 110485449
N-(2-ethyl-6-methylphenyl)-3,4-dihydroxybenzamide
CID 113199272
3-bromo-N-(2-ethyl-6-methylphenyl)-4-methylbenzamide
CID 4936095
N-(2-ethyl-6-methylphenyl)-3-iodo-4-methylbenzamide
CID 4936097
N-(2-chloro-4-methyl-3-pyridinyl)-1H-indole-6-carboxamide
CID 65490101
N-(2,6-diethylphenyl)-2-oxo-1H-pyridine-4-carboxamide
CID 110600773
N-(2-ethyl-6-methylphenyl)-3-methyl-4-(methylamino)benzamide
CID 63209862
N-(2-ethyl-6-methylphenyl)-3-sulfanylbenzamide
CID 107019745
N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325541
N-(2-ethyl-6-methylphenyl)-4-sulfanylbenzamide
CID 107019746
4-tert-butyl-N-(2-ethyl-6-methylphenyl)benzamide
CID 1226062

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide (CID 60773719) is N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide is CCc1cccc(C)c1NC(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide?
The InChIKey is RNEGQBCCDSXQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-8-7-14-9-10-19-16(14)11-15/h4-11,19H,3H2,1-2H3,(H,20,21).
What are the key properties of N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide?
N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 4.29, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 60773719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).