6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide

C23H20N2O3 — CID 113206666

IUPAC6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)Nc3ccc(OCc4ccccc4)cc3)c[nH]c2c1
InChIInChI=1S/C23H20N2O3/c1-27-19-11-12-20-21(14-24-22(20)13-19)23(26)25-17-7-9-18(10-8-17)28-15-16-5-3-2-4-6-16/h2-14,24H,15H2,1H3,(H,25,26)
InChIKeyJRDWJZUUNJVOQZ-UHFFFAOYSA-N
MW372.42 g/mol
LogP5.01
Rot. Bonds6

About 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide

6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide (PubChem CID 113206666) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide
PubChem CID113206666
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)Nc3ccc(OCc4ccccc4)cc3)c[nH]c2c1
InChIInChI=1S/C23H20N2O3/c1-27-19-11-12-20-21(14-24-22(20)13-19)23(26)25-17-7-9-18(10-8-17)28-15-16-5-3-2-4-6-16/h2-14,24H,15H2,1H3,(H,25,26)
InChIKeyJRDWJZUUNJVOQZ-UHFFFAOYSA-N
XLogP5.01
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.42
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 6-phenylmethoxy-1H-indole-3-carboxylate
CID 57455165
6-methoxy-N-[4-(trifluoromethyl)phenyl]-1H-indole-3-carboxamide
CID 113206647
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 2791610
N-(3-chloro-4-methoxyphenyl)-6-methoxy-1H-indole-3-carboxamide
CID 113206630
2,3-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 27650117
3,5-dimethoxy-4-phenylmethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 139779676
6-chloro-N-(4-ethoxyphenyl)-1H-indole-3-carboxamide
CID 113206447
2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide
CID 100708399
2-iodo-N-(4-phenylmethoxyphenyl)benzamide
CID 615692
3-(3-methoxyphenyl)-N-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 46856863
5-methoxy-N-(4-methylphenyl)-1H-indole-3-carboxamide
CID 113206039
5,6-dimethoxy-N-phenyl-1H-indole-3-carboxamide
CID 113206946

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide?
The IUPAC name of 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide (CID 113206666) is 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide is COc1ccc2c(C(=O)Nc3ccc(OCc4ccccc4)cc3)c[nH]c2c1.
What is the InChIKey of 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide?
The InChIKey is JRDWJZUUNJVOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-27-19-11-12-20-21(14-24-22(20)13-19)23(26)25-17-7-9-18(10-8-17)28-15-16-5-3-2-4-6-16/h2-14,24H,15H2,1H3,(H,25,26).
What are the key properties of 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide?
6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide has a molecular weight of 372.42 g/mol, XLogP of 5.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(4-phenylmethoxyphenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113206666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).