N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide

C19H20N2O — CID 113207113

IUPACN-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide
SMILESCCN(C(=O)c1cc2ccccc2n1C)c1cccc(C)c1
InChIInChI=1S/C19H20N2O/c1-4-21(16-10-7-8-14(2)12-16)19(22)18-13-15-9-5-6-11-17(15)20(18)3/h5-13H,4H2,1-3H3
InChIKeyGCIIFZIXAPTRFN-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.15
Rot. Bonds3

About N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide

N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide (PubChem CID 113207113) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide
PubChem CID113207113
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC NameN-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide
SMILESCCN(C(=O)c1cc2ccccc2n1C)c1cccc(C)c1
InChIInChI=1S/C19H20N2O/c1-4-21(16-10-7-8-14(2)12-16)19(22)18-13-15-9-5-6-11-17(15)20(18)3/h5-13H,4H2,1-3H3
InChIKeyGCIIFZIXAPTRFN-UHFFFAOYSA-N
XLogP4.15
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 62239482
N-ethyl-6,10-dimethyl-N-(3-methylphenyl)-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
CID 984705
1-(2-aminoethyl)-N-ethyl-N-(3-methylphenyl)imidazole-4-carboxamide
CID 107497434
N-ethyl-6-(N-ethylanilino)-2-methyl-N-(3-methylphenyl)pyrimidine-4-carboxamide
CID 112849511
N-ethyl-N-(3-methylphenyl)-4-sulfanylbenzamide
CID 107023760
1-N,1-N,4-N-triethyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109048470
2-[methyl-(1-methylindole-2-carbonyl)amino]acetic acid
CID 110834916
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605
4,5-dibromo-N-ethyl-N-(3-methylphenyl)thiophene-2-carboxamide
CID 113221701
N-ethyl-N-(3-methylphenyl)-3-pyrrol-1-ylbenzamide
CID 110295328
N,4-diethyl-N-(3-methylphenyl)benzamide
CID 533234
N-ethyl-N,2-bis(3-methylphenyl)acetamide
CID 113099036

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide?
The IUPAC name of N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide (CID 113207113) is N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide.
What is the SMILES notation for N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide?
The canonical SMILES for N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide is CCN(C(=O)c1cc2ccccc2n1C)c1cccc(C)c1.
What is the InChIKey of N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide?
The InChIKey is GCIIFZIXAPTRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-4-21(16-10-7-8-14(2)12-16)19(22)18-13-15-9-5-6-11-17(15)20(18)3/h5-13H,4H2,1-3H3.
What are the key properties of N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide?
N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 4.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methyl-N-(3-methylphenyl)indole-2-carboxamide is sourced from PubChem (CID 113207113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).