N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide

C17H16N2O2 — CID 9270219

IUPACN-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H16N2O2/c1-21-16-9-5-3-7-13(16)11-18-17(20)15-10-12-6-2-4-8-14(12)19-15/h2-10,19H,11H2,1H3,(H,18,20)
InChIKeyUHLSZMLUYLHJLN-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.11
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide

N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide (PubChem CID 9270219) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide
PubChem CID9270219
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H16N2O2/c1-21-16-9-5-3-7-13(16)11-18-17(20)15-10-12-6-2-4-8-14(12)19-15/h2-10,19H,11H2,1H3,(H,18,20)
InChIKeyUHLSZMLUYLHJLN-UHFFFAOYSA-N
XLogP3.11
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,5-dimethoxyphenyl)methyl]-1H-indole-2-carboxamide
CID 34866358
N-[(3,4,5-trimethoxyphenyl)methyl]-1H-indole-2-carboxamide
CID 9483409
N-[(2-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 9374796
N-(cyanomethyl)-1H-indole-2-carboxamide
CID 61260784
N-[(2-chloro-4-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 46921177
3-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-pyrazole-5-carboxamide
CID 20918238
N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-1H-indole-2-carboxamide
CID 34565384
N-benzyl-5,6-dimethoxy-1H-indole-2-carboxamide;hydrochloride
CID 44664335
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701179
N-[(4-bromophenyl)methyl]-1H-indole-2-carboxamide
CID 46921176
N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide
CID 51979700

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide (CID 9270219) is N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide is COc1ccccc1CNC(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide?
The InChIKey is UHLSZMLUYLHJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-21-16-9-5-3-7-13(16)11-18-17(20)15-10-12-6-2-4-8-14(12)19-15/h2-10,19H,11H2,1H3,(H,18,20).
What are the key properties of N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide?
N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 9270219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).