N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide

C18H18N2O3 — CID 110762508

IUPACN-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2c(C)[nH]c3ccccc23)c1
InChIInChI=1S/C18H18N2O3/c1-11-17(13-6-4-5-7-14(13)19-11)18(21)20-15-10-12(22-2)8-9-16(15)23-3/h4-10,19H,1-3H3,(H,20,21)
InChIKeyQITQLVFVRWLAHA-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.75
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide

N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide (PubChem CID 110762508) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide
PubChem CID110762508
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2c(C)[nH]c3ccccc23)c1
InChIInChI=1S/C18H18N2O3/c1-11-17(13-6-4-5-7-14(13)19-11)18(21)20-15-10-12(22-2)8-9-16(15)23-3/h4-10,19H,1-3H3,(H,20,21)
InChIKeyQITQLVFVRWLAHA-UHFFFAOYSA-N
XLogP3.75
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 4779254
6-fluoro-N-(2-methoxyphenyl)-2-methyl-1H-indole-3-carboxamide
CID 110859831
N-(2,4-dimethoxyphenyl)-6-fluoro-2-methyl-1H-indole-3-carboxamide
CID 110860582
N-(2,5-dimethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide
CID 20855954
1-(2,5-dimethoxyphenyl)-3-[2-(4-methylphenyl)-1H-indol-3-yl]urea
CID 53114266
N-(2,5-dimethoxyphenyl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212208
(3,4-dimethoxyphenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 15104433
(2S)-2-(2-methoxy-5-methylanilino)-1-(2-methyl-1H-indol-3-yl)propan-1-one
CID 29457626
ethyl 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-1H-indole-2-carboxylate
CID 2157265
4-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049315
7-methoxy-N-(3-methoxyphenyl)-2-methyl-1H-indole-3-carboxamide
CID 110859939
N-(2,5-dimethoxyphenyl)-4,6-dimethyl-1H-indole-2-carboxamide
CID 134032979

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide (CID 110762508) is N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide is COc1ccc(OC)c(NC(=O)c2c(C)[nH]c3ccccc23)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide?
The InChIKey is QITQLVFVRWLAHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-11-17(13-6-4-5-7-14(13)19-11)18(21)20-15-10-12(22-2)8-9-16(15)23-3/h4-10,19H,1-3H3,(H,20,21).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide?
N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110762508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).