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

C17H18N2O3 — CID 110860613

IUPACN-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3ccccc3N2)c(OC)c1
InChIInChI=1S/C17H18N2O3/c1-21-12-7-8-14(16(10-12)22-2)19-17(20)15-9-11-5-3-4-6-13(11)18-15/h3-8,10,15,18H,9H2,1-2H3,(H,19,20)
InChIKeyHBDZANIMHNSQJE-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.68
Rot. Bonds4

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

N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 110860613) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID110860613
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOc1ccc(NC(=O)C2Cc3ccccc3N2)c(OC)c1
InChIInChI=1S/C17H18N2O3/c1-21-12-7-8-14(16(10-12)22-2)19-17(20)15-9-11-5-3-4-6-13(11)18-15/h3-8,10,15,18H,9H2,1-2H3,(H,19,20)
InChIKeyHBDZANIMHNSQJE-UHFFFAOYSA-N
XLogP2.68
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76951044
methyl 2-(2,3-dihydro-1H-indole-2-carbonylamino)benzoate
CID 110861590
N-(3-hydroxy-2,4-dimethylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76887740
N-(2,4-dimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 134002451
N-(2,4-dimethoxyphenyl)-5-phenylpyrazolidine-3-carboxamide
CID 74523011
(2S)-N-(5-chloro-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61147929
N-(2,5-dimethoxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112520928
methyl 4-(2,3-dihydro-1H-indole-2-carbonylamino)benzoate
CID 110861747
5-fluoro-N-(4-methoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 71066395
N-(2-methyl-3-pyridinyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 80567402
(2S)-N-(3-bromo-2-hydroxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 81495794
(2S)-N-(2,3-dichlorophenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61148394

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide (CID 110860613) is N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide is COc1ccc(NC(=O)C2Cc3ccccc3N2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is HBDZANIMHNSQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-21-12-7-8-14(16(10-12)22-2)19-17(20)15-9-11-5-3-4-6-13(11)18-15/h3-8,10,15,18H,9H2,1-2H3,(H,19,20).
What are the key properties of N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide?
N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 298.34 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 110860613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).