6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide

C18H18N2O3 — CID 113206539

IUPAC6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2c[nH]c3cc(OC)ccc23)cc1
InChIInChI=1S/C18H18N2O3/c1-22-13-5-3-12(4-6-13)10-20-18(21)16-11-19-17-9-14(23-2)7-8-15(16)17/h3-9,11,19H,10H2,1-2H3,(H,20,21)
InChIKeyZUJIDVWNUWGZAJ-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.12
Rot. Bonds5

About 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide

6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide (PubChem CID 113206539) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide
PubChem CID113206539
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2c[nH]c3cc(OC)ccc23)cc1
InChIInChI=1S/C18H18N2O3/c1-22-13-5-3-12(4-6-13)10-20-18(21)16-11-19-17-9-14(23-2)7-8-15(16)17/h3-9,11,19H,10H2,1-2H3,(H,20,21)
InChIKeyZUJIDVWNUWGZAJ-UHFFFAOYSA-N
XLogP3.12
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-6-methoxy-1H-indole-3-carboxamide
CID 113206537
6-methoxy-N-[(2-methylphenyl)methyl]-1H-indole-3-carboxamide
CID 113206529
5-chloro-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide
CID 113205803
N-butyl-6-methoxy-1H-indole-3-carboxamide
CID 113206507
6-methoxy-N-prop-2-enyl-1H-indole-3-carboxamide
CID 113206506
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-1H-indole-3-carboxamide
CID 113206560
6-chloro-N-[2-(4-methoxyphenyl)ethyl]-1H-indole-3-carboxamide
CID 113206381
N-[[3-(3-amino-5-chlorophenoxy)-4-chlorophenyl]methyl]-6-methoxy-1H-indole-3-carboxamide
CID 89041845
N-benzyl-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 18473067
6-methoxy-N-[(4-methoxyphenyl)methyl]-3-methyl-1H-indole-2-carboxamide
CID 113205411
N-[(4-methoxyphenyl)methyl]-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 110851663
2,2,2-trifluoro-1-(6-methoxy-1H-indol-3-yl)ethanone
CID 22497238

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide?
The IUPAC name of 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide (CID 113206539) is 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide?
The canonical SMILES for 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide is COc1ccc(CNC(=O)c2c[nH]c3cc(OC)ccc23)cc1.
What is the InChIKey of 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide?
The InChIKey is ZUJIDVWNUWGZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-22-13-5-3-12(4-6-13)10-20-18(21)16-11-19-17-9-14(23-2)7-8-15(16)17/h3-9,11,19H,10H2,1-2H3,(H,20,21).
What are the key properties of 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide?
6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide is sourced from PubChem (CID 113206539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).