(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide

C18H18N2O3 — CID 41428728

IUPAC(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide
SMILESCCOc1ccccc1C(=O)N1c2ccccc2C[C@@H]1C(N)=O
InChIInChI=1S/C18H18N2O3/c1-2-23-16-10-6-4-8-13(16)18(22)20-14-9-5-3-7-12(14)11-15(20)17(19)21/h3-10,15H,2,11H2,1H3,(H2,19,21)/t15-/m1/s1
InChIKeyVBBRIMXMTDBSFD-OAHLLOKOSA-N
MW310.35 g/mol
LogP2.14
Rot. Bonds4

About (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide

(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide (PubChem CID 41428728) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide
PubChem CID41428728
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide
SMILESCCOc1ccccc1C(=O)N1c2ccccc2C[C@@H]1C(N)=O
InChIInChI=1S/C18H18N2O3/c1-2-23-16-10-6-4-8-13(16)18(22)20-14-9-5-3-7-12(14)11-15(20)17(19)21/h3-10,15H,2,11H2,1H3,(H2,19,21)/t15-/m1/s1
InChIKeyVBBRIMXMTDBSFD-OAHLLOKOSA-N
XLogP2.14
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-diethoxybenzoyl)-2,3-dihydroindole-2-carboxamide
CID 18587923
(2S)-1-(3,4,5-trimethoxybenzoyl)-2,3-dihydroindole-2-carboxamide
CID 41428756
(2R)-1-(4-chlorobenzoyl)-2,3-dihydroindole-2-carboxamide
CID 41428763
(2-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 19061805
(2S)-1-(3-methylbenzoyl)-2,3-dihydroindole-2-carboxamide
CID 41428724
(2R)-1-(3,4-dimethylbenzoyl)-2,3-dihydroindole-2-carboxamide
CID 40829167
(2S)-1-[4-[(R)-methylsulfinyl]benzoyl]-2,3-dihydroindole-2-carboxamide
CID 95146370
(2S)-1-[4-(diethylsulfamoyl)benzoyl]-2,3-dihydroindole-2-carboxamide
CID 41428851
(2S)-1-(5-acetamido-2-fluorobenzoyl)-2,3-dihydroindole-2-carboxamide
CID 56822734
(2R)-1-[2-(4-ethoxyphenoxy)acetyl]-N-methyl-2,3-dihydroindole-2-carboxamide
CID 41428952
(2S)-1-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide
CID 41428895
[4-(2-chlorophenyl)piperazin-1-yl]-(2-ethoxyphenyl)methanone
CID 27535905

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide?
The IUPAC name of (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide (CID 41428728) is (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide.
What is the SMILES notation for (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide?
The canonical SMILES for (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide is CCOc1ccccc1C(=O)N1c2ccccc2C[C@@H]1C(N)=O.
What is the InChIKey of (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide?
The InChIKey is VBBRIMXMTDBSFD-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-2-23-16-10-6-4-8-13(16)18(22)20-14-9-5-3-7-12(14)11-15(20)17(19)21/h3-10,15H,2,11H2,1H3,(H2,19,21)/t15-/m1/s1.
What are the key properties of (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide?
(2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-ethoxybenzoyl)-2,3-dihydroindole-2-carboxamide is sourced from PubChem (CID 41428728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).