6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide

C25H24N2O3 — CID 55694524

IUPAC6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)NCc3ccc(COCc4ccccc4)cc3)[nH]c2c1
InChIInChI=1S/C25H24N2O3/c1-29-22-12-11-21-13-24(27-23(21)14-22)25(28)26-15-18-7-9-20(10-8-18)17-30-16-19-5-3-2-4-6-19/h2-14,27H,15-17H2,1H3,(H,26,28)
InChIKeyBVZHZJPZWULQIP-UHFFFAOYSA-N
MW400.48 g/mol
LogP4.82
Rot. Bonds8

About 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide

6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide (PubChem CID 55694524) has the molecular formula C25H24N2O3 and a molecular weight of 400.48 g/mol. Its IUPAC name is 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide
PubChem CID55694524
Molecular FormulaC25H24N2O3
Molecular Weight400.48 g/mol
Exact Mass400.18
IUPAC Name6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)NCc3ccc(COCc4ccccc4)cc3)[nH]c2c1
InChIInChI=1S/C25H24N2O3/c1-29-22-12-11-21-13-24(27-23(21)14-22)25(28)26-15-18-7-9-20(10-8-18)17-30-16-19-5-3-2-4-6-19/h2-14,27H,15-17H2,1H3,(H,26,28)
InChIKeyBVZHZJPZWULQIP-UHFFFAOYSA-N
XLogP4.82
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[(dimethylamino)methyl]phenyl]methyl]-6-methoxy-1H-indole-2-carboxamide
CID 38420989
benzyl 2-[(6-methoxy-1H-indole-2-carbonyl)amino]acetate
CID 38424752
N-[(4-chlorophenyl)methyl]-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112521847
N-[[4-(1-hydroxyethyl)phenyl]methyl]-6-methoxy-1H-indole-2-carboxamide
CID 75417280
6-methoxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide
CID 39983983
N-(2-benzamidoethyl)-6-methoxy-1H-indole-2-carboxamide
CID 134003045
N-benzyl-5,6-dimethoxy-1H-indole-2-carboxamide;hydrochloride
CID 44664335
6-methoxy-N-[(3-pyridin-2-yloxyphenyl)methyl]-1H-indole-2-carboxamide
CID 90596329
N-[(3-bromo-5-fluorophenyl)methyl]-6-methoxy-1H-indole-2-carboxamide
CID 55953711
6-methoxy-N-[(2-thiophen-3-ylphenyl)methyl]-1H-indole-2-carboxamide
CID 71809971
6-methoxy-N-[(3-methyl-4-oxophthalazin-1-yl)methyl]-1H-indole-2-carboxamide
CID 71779476
N-[[4-(difluoromethoxy)phenyl]methyl]-1H-indole-2-carboxamide
CID 42006153

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide?
The IUPAC name of 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide (CID 55694524) is 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide?
The canonical SMILES for 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide is COc1ccc2cc(C(=O)NCc3ccc(COCc4ccccc4)cc3)[nH]c2c1.
What is the InChIKey of 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide?
The InChIKey is BVZHZJPZWULQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O3/c1-29-22-12-11-21-13-24(27-23(21)14-22)25(28)26-15-18-7-9-20(10-8-18)17-30-16-19-5-3-2-4-6-19/h2-14,27H,15-17H2,1H3,(H,26,28).
What are the key properties of 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide?
6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide has a molecular weight of 400.48 g/mol, XLogP of 4.82, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 55694524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).