N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide

C17H18N2O2 — CID 76951044

IUPACN-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3ccccc3N2)c(C)c1
InChIInChI=1S/C17H18N2O2/c1-11-9-13(21-2)7-8-14(11)19-17(20)16-10-12-5-3-4-6-15(12)18-16/h3-9,16,18H,10H2,1-2H3,(H,19,20)
InChIKeyZVMBAVFDIUGFOQ-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.98
Rot. Bonds3

About N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide

N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76951044) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76951044
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3ccccc3N2)c(C)c1
InChIInChI=1S/C17H18N2O2/c1-11-9-13(21-2)7-8-14(11)19-17(20)16-10-12-5-3-4-6-15(12)18-16/h3-9,16,18H,10H2,1-2H3,(H,19,20)
InChIKeyZVMBAVFDIUGFOQ-UHFFFAOYSA-N
XLogP2.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 110860613
N-(4-hydroxy-2,5-dimethylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106954312
N-(3-hydroxy-2,4-dimethylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76887740
(2S)-N-(5-bromo-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61178266
(2S)-N-(5-chloro-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61147929
methyl 2-(2,3-dihydro-1H-indole-2-carbonylamino)benzoate
CID 110861590
(2R)-N-(4-methoxy-2-methylphenyl)pyrrolidine-2-carboxamide
CID 92930229
N-(4-methoxy-2-methylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119281659
N-(3-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 107701339
N-(2-methyl-3-pyridinyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 80567402
4-hydroxy-N-(4-methoxy-2-methylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119709484
(2S)-N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 62813197

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide (CID 76951044) is N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide is COc1ccc(NC(=O)C2Cc3ccccc3N2)c(C)c1.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is ZVMBAVFDIUGFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-11-9-13(21-2)7-8-14(11)19-17(20)16-10-12-5-3-4-6-15(12)18-16/h3-9,16,18H,10H2,1-2H3,(H,19,20).
What are the key properties of N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76951044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).