5-methoxy-1-methyl-N-phenylindole-2-carboxamide

C17H16N2O2 — CID 10707870

IUPAC5-methoxy-1-methyl-N-phenylindole-2-carboxamide
SMILESCOc1ccc2c(c1)cc(C(=O)Nc1ccccc1)n2C
InChIInChI=1S/C17H16N2O2/c1-19-15-9-8-14(21-2)10-12(15)11-16(19)17(20)18-13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,20)
InChIKeyJPFRUCFGDGJGMJ-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.44
Rot. Bonds3

About 5-methoxy-1-methyl-N-phenylindole-2-carboxamide

5-methoxy-1-methyl-N-phenylindole-2-carboxamide (PubChem CID 10707870) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-methoxy-1-methyl-N-phenylindole-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-1-methyl-N-phenylindole-2-carboxamide
PubChem CID10707870
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name5-methoxy-1-methyl-N-phenylindole-2-carboxamide
SMILESCOc1ccc2c(c1)cc(C(=O)Nc1ccccc1)n2C
InChIInChI=1S/C17H16N2O2/c1-19-15-9-8-14(21-2)10-12(15)11-16(19)17(20)18-13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,20)
InChIKeyJPFRUCFGDGJGMJ-UHFFFAOYSA-N
XLogP3.44
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide
CID 110861255
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-1-methylindole-2-carboxamide
CID 60529287
1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide
CID 7329101
N-(6-methoxy-1-methyl-2-oxoquinolin-3-yl)benzamide
CID 101228890
N-(1-aminopropan-2-yl)-5-methoxy-1-methylindole-2-carboxamide
CID 110833437
N-(6-methoxy-3-pyridinyl)-1-methylindole-2-carboxamide
CID 56763350
(2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoate
CID 7070170
2-[2-[(5-methoxy-1-methylindole-2-carbonyl)amino]propanoylamino]-3-phenylpropanoic acid
CID 4868507
1-methyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamoyl]indole-5-carboxylic acid
CID 58408799
3-hydroxy-4-[(Z)-[(5-methoxy-1-methylindole-2-carbonyl)hydrazinylidene]methyl]naphthalene-2-carboxylic acid
CID 136919380
N-[[3-(dimethylamino)phenyl]methyl]-5-methoxy-1-methylindole-2-carboxamide
CID 70739975
5-methoxy-1-methyl-N-(1-phenyl-3,6-diazatricyclo[4.3.1.13,8]undecan-9-yl)indole-2-carboxamide
CID 131898552

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-N-phenylindole-2-carboxamide?
The IUPAC name of 5-methoxy-1-methyl-N-phenylindole-2-carboxamide (CID 10707870) is 5-methoxy-1-methyl-N-phenylindole-2-carboxamide.
What is the SMILES notation for 5-methoxy-1-methyl-N-phenylindole-2-carboxamide?
The canonical SMILES for 5-methoxy-1-methyl-N-phenylindole-2-carboxamide is COc1ccc2c(c1)cc(C(=O)Nc1ccccc1)n2C.
What is the InChIKey of 5-methoxy-1-methyl-N-phenylindole-2-carboxamide?
The InChIKey is JPFRUCFGDGJGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-19-15-9-8-14(21-2)10-12(15)11-16(19)17(20)18-13-6-4-3-5-7-13/h3-11H,1-2H3,(H,18,20).
What are the key properties of 5-methoxy-1-methyl-N-phenylindole-2-carboxamide?
5-methoxy-1-methyl-N-phenylindole-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-N-phenylindole-2-carboxamide is sourced from PubChem (CID 10707870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).