N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide

C20H22N2O4 — CID 71897962

IUPACN-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2cc3ccc(OC)cc3[nH]2)c(OC)c1
InChIInChI=1S/C20H22N2O4/c1-12(16-8-7-15(25-3)11-19(16)26-4)21-20(23)18-9-13-5-6-14(24-2)10-17(13)22-18/h5-12,22H,1-4H3,(H,21,23)
InChIKeyYYWMGSXWIPKNTG-UHFFFAOYSA-N
MW354.41 g/mol
LogP3.68
Rot. Bonds6

About N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide

N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide (PubChem CID 71897962) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide
PubChem CID71897962
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC NameN-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2cc3ccc(OC)cc3[nH]2)c(OC)c1
InChIInChI=1S/C20H22N2O4/c1-12(16-8-7-15(25-3)11-19(16)26-4)21-20(23)18-9-13-5-6-14(24-2)10-17(13)22-18/h5-12,22H,1-4H3,(H,21,23)
InChIKeyYYWMGSXWIPKNTG-UHFFFAOYSA-N
XLogP3.68
TPSA72.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-[1-(2,4-dimethoxyphenyl)ethyl]-1H-indole-2-carboxamide
CID 55579430
N-(1-aminopropan-2-yl)-6-methoxy-1H-indole-2-carboxamide
CID 110833539
N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-5-fluoro-1H-indole-2-carboxamide
CID 39983681
5-methoxy-N-propan-2-yl-1H-indole-2-carboxamide
CID 110847836
methyl 4-[[(1R)-1-(2,4-dimethoxyphenyl)ethyl]carbamoyl]benzoate
CID 94045094
N-[1-(2,4-dimethoxyphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 60968183
2,6-dichloro-N-[1-(2,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
CID 86846897
N-[1-(2,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 134053802
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
CID 4163313
(2S)-2-[(5-methoxy-1H-indole-2-carbonyl)amino]propanoic acid
CID 110834885
N-(5-acetamido-2-methoxyphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 46445599
N-[(1S)-2-(dimethylamino)-1-phenylethyl]-6-methoxy-1H-indole-2-carboxamide
CID 39984120

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide?
The IUPAC name of N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide (CID 71897962) is N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide.
What is the SMILES notation for N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide?
The canonical SMILES for N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide is COc1ccc(C(C)NC(=O)c2cc3ccc(OC)cc3[nH]2)c(OC)c1.
What is the InChIKey of N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide?
The InChIKey is YYWMGSXWIPKNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4/c1-12(16-8-7-15(25-3)11-19(16)26-4)21-20(23)18-9-13-5-6-14(24-2)10-17(13)22-18/h5-12,22H,1-4H3,(H,21,23).
What are the key properties of N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide?
N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-2-carboxamide is sourced from PubChem (CID 71897962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).