N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide

C22H24N2O4 — CID 109143683

IUPACN-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2CC2C(=O)N2c3ccccc3CC2C)c(OC)c1
InChIInChI=1S/C22H24N2O4/c1-13-10-14-6-4-5-7-19(14)24(13)22(26)17-12-16(17)21(25)23-18-9-8-15(27-2)11-20(18)28-3/h4-9,11,13,16-17H,10,12H2,1-3H3,(H,23,25)
InChIKeyLAJJLAQJAFKVNE-UHFFFAOYSA-N
MW380.44 g/mol
LogP3.26
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide

N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide (PubChem CID 109143683) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
PubChem CID109143683
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC NameN-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2CC2C(=O)N2c3ccccc3CC2C)c(OC)c1
InChIInChI=1S/C22H24N2O4/c1-13-10-14-6-4-5-7-19(14)24(13)22(26)17-12-16(17)21(25)23-18-9-8-15(27-2)11-20(18)28-3/h4-9,11,13,16-17H,10,12H2,1-3H3,(H,23,25)
InChIKeyLAJJLAQJAFKVNE-UHFFFAOYSA-N
XLogP3.26
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dichlorophenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109144144
(2R)-1-N-(2,4-dimethoxyphenyl)-2,3-dihydroindole-1,2-dicarboxamide
CID 41232320
N-(3-methoxypropyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109133248
2-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-propylcyclopropane-1-carboxamide
CID 109130596
2-N-benzyl-1-N-(2,4-dimethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109135078
2-N-(4-acetamidophenyl)-1-N-(2,4-dimethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143673
[4-(2,4-dimethoxyanilino)-2-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109222011
6-[(2,4-dimethoxyphenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 17379150
2-N-(2,4-dimethoxyphenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141778
N-[3-(dimethylamino)propyl]-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109134117
2-N-(2,4-dimethoxyphenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141613
1-N-(2,4-dimethoxyphenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130555

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide (CID 109143683) is N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide is COc1ccc(NC(=O)C2CC2C(=O)N2c3ccccc3CC2C)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide?
The InChIKey is LAJJLAQJAFKVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-13-10-14-6-4-5-7-19(14)24(13)22(26)17-12-16(17)21(25)23-18-9-8-15(27-2)11-20(18)28-3/h4-9,11,13,16-17H,10,12H2,1-3H3,(H,23,25).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide?
N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide has a molecular weight of 380.44 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 109143683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).