5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide

C18H18N2O4 — CID 113206986

IUPAC5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide
SMILESCOc1cccc(NC(=O)c2c[nH]c3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C18H18N2O4/c1-22-12-6-4-5-11(7-12)20-18(21)14-10-19-15-9-17(24-3)16(23-2)8-13(14)15/h4-10,19H,1-3H3,(H,20,21)
InChIKeyBQXAEOCHCDMECX-UHFFFAOYSA-N
MW326.35 g/mol
LogP3.45
Rot. Bonds5

About 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide

5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide (PubChem CID 113206986) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide
PubChem CID113206986
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide
SMILESCOc1cccc(NC(=O)c2c[nH]c3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C18H18N2O4/c1-22-12-6-4-5-11(7-12)20-18(21)14-10-19-15-9-17(24-3)16(23-2)8-13(14)15/h4-10,19H,1-3H3,(H,20,21)
InChIKeyBQXAEOCHCDMECX-UHFFFAOYSA-N
XLogP3.45
TPSA72.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-5,6-dimethoxy-1H-indole-3-carboxamide
CID 113207001
5,6-dimethoxy-N-phenyl-1H-indole-3-carboxamide
CID 113206946
5,6-dimethoxy-N-(4-propan-2-yloxyphenyl)-1H-indole-3-carboxamide
CID 113206992
N-(2,6-difluorophenyl)-5,6-dimethoxy-1H-indole-3-carboxamide
CID 113207048
N-(2,6-diethylphenyl)-5,6-dimethoxy-1H-indole-3-carboxamide
CID 113206966
2,3-dimethoxy-N-(3-methoxyphenyl)benzamide
CID 912443
5,6-dimethoxy-N-(2-propan-2-yloxyphenyl)-1H-indole-3-carboxamide
CID 113206991
5-methoxy-N-(3,4,5-trimethoxyphenyl)-1H-indole-3-carboxamide
CID 113206118
N-(3-chloro-4-methoxyphenyl)-6-methoxy-1H-indole-3-carboxamide
CID 113206630
N-(3-methoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 110860019
N-(3-hydroxyphenyl)-5,6,7-trimethoxy-4-oxo-1H-quinoline-3-carboxamide
CID 137464589
5-methoxy-N-(4-methylphenyl)-1H-indole-3-carboxamide
CID 113206039

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide?
The IUPAC name of 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide (CID 113206986) is 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide?
The canonical SMILES for 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide is COc1cccc(NC(=O)c2c[nH]c3cc(OC)c(OC)cc23)c1.
What is the InChIKey of 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide?
The InChIKey is BQXAEOCHCDMECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-22-12-6-4-5-11(7-12)20-18(21)14-10-19-15-9-17(24-3)16(23-2)8-13(14)15/h4-10,19H,1-3H3,(H,20,21).
What are the key properties of 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide?
5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide has a molecular weight of 326.35 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-N-(3-methoxyphenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113206986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).