N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide

C18H20N2O — CID 43325541

IUPACN-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C18H20N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-7-8-16-14(11-15)9-10-19-16/h4-8,11,19H,3,9-10H2,1-2H3,(H,20,21)
InChIKeyLPOBCAGEYYXAIM-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.78
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide

N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 43325541) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID43325541
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C18H20N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-7-8-16-14(11-15)9-10-19-16/h4-8,11,19H,3,9-10H2,1-2H3,(H,20,21)
InChIKeyLPOBCAGEYYXAIM-UHFFFAOYSA-N
XLogP3.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 110858019
N-(2-ethyl-6-methylphenyl)-3,4-dihydroxybenzamide
CID 113199272
N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
CID 60773719
N-(2-ethyl-6-methylphenyl)-1H-indazole-5-carboxamide
CID 110485449
3-bromo-N-(2-ethyl-6-methylphenyl)-4-methylbenzamide
CID 4936095
N-(2-ethyl-6-methylphenyl)-3-iodo-4-methylbenzamide
CID 4936097
3-amino-4-bromo-N-(2-ethyl-6-methylphenyl)benzamide
CID 61090453
N-(4-methyl-1H-pyrazol-5-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104618997
N-(2-ethyl-6-methylphenyl)-3-methyl-4-(methylamino)benzamide
CID 63209862
N-(3-bromo-4-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 63334695
N-(2-ethyl-6-methylphenyl)-3-sulfanylbenzamide
CID 107019745
N-pyrimidin-2-yl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142516

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide (CID 43325541) is N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide is CCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is LPOBCAGEYYXAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-3-13-6-4-5-12(2)17(13)20-18(21)15-7-8-16-14(11-15)9-10-19-16/h4-8,11,19H,3,9-10H2,1-2H3,(H,20,21).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 43325541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).