N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide

C18H18N2O3 — CID 25343212

IUPACN-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cn(C)c3ccccc23)c1
InChIInChI=1S/C18H18N2O3/c1-20-11-14(13-6-4-5-7-16(13)20)18(21)19-15-10-12(22-2)8-9-17(15)23-3/h4-11H,1-3H3,(H,19,21)
InChIKeyWZXNBDJVXPLUBF-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.45
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide

N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide (PubChem CID 25343212) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide
PubChem CID25343212
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cn(C)c3ccccc23)c1
InChIInChI=1S/C18H18N2O3/c1-20-11-14(13-6-4-5-7-16(13)20)18(21)19-15-10-12(22-2)8-9-17(15)23-3/h4-11H,1-3H3,(H,19,21)
InChIKeyWZXNBDJVXPLUBF-UHFFFAOYSA-N
XLogP3.45
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
CID 9208634
N-(5-chloro-2-methoxyphenyl)-1-methylindole-3-carboxamide
CID 29202307
N'-(2,4-dimethoxybenzoyl)-1-methylindole-3-carbohydrazide
CID 40717267
N-(2,5-dimethoxyphenyl)-2-(1-methylindol-3-yl)sulfanylacetamide
CID 4064020
1-acetyl-N-(2,5-dimethoxyphenyl)-5-methoxyindole-3-carboxamide
CID 113212814
N-[3-(difluoromethoxy)-4-methoxyphenyl]-1-methylindole-3-carboxamide
CID 46530558
N-[(4-methoxyphenyl)methyl]-1-methylindole-3-carboxamide
CID 9208154
5-bromo-N-(2,5-dimethoxyphenyl)naphthalene-1-carboxamide
CID 1369979
N-(2,5-dimethoxyphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 4779254
N-(2,5-dimethoxyphenyl)-2-methylsulfanylbenzamide
CID 966884
2-[2-[(2,5-dimethoxyphenyl)carbamoyl]phenyl]benzoic acid
CID 1348361
1-methyl-N-phenylindole-3-carboxamide
CID 9038340

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide (CID 25343212) is N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide is COc1ccc(OC)c(NC(=O)c2cn(C)c3ccccc23)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide?
The InChIKey is WZXNBDJVXPLUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-20-11-14(13-6-4-5-7-16(13)20)18(21)19-15-10-12(22-2)8-9-17(15)23-3/h4-11H,1-3H3,(H,19,21).
What are the key properties of N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide?
N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide is sourced from PubChem (CID 25343212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).