N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide

C18H20N2O — CID 108991479

IUPACN-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESCCc1ccccc1NC(=O)N1c2ccccc2CC1C
InChIInChI=1S/C18H20N2O/c1-3-14-8-4-6-10-16(14)19-18(21)20-13(2)12-15-9-5-7-11-17(15)20/h4-11,13H,3,12H2,1-2H3,(H,19,21)
InChIKeyYIKZYRQAHAQLMA-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.23
Rot. Bonds2

About N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide

N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide (PubChem CID 108991479) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
PubChem CID108991479
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESCCc1ccccc1NC(=O)N1c2ccccc2CC1C
InChIInChI=1S/C18H20N2O/c1-3-14-8-4-6-10-16(14)19-18(21)20-13(2)12-15-9-5-7-11-17(15)20/h4-11,13H,3,12H2,1-2H3,(H,19,21)
InChIKeyYIKZYRQAHAQLMA-UHFFFAOYSA-N
XLogP4.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide (CID 108991479) is N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide is CCc1ccccc1NC(=O)N1c2ccccc2CC1C.
What is the InChIKey of N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The InChIKey is YIKZYRQAHAQLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-3-14-8-4-6-10-16(14)19-18(21)20-13(2)12-15-9-5-7-11-17(15)20/h4-11,13H,3,12H2,1-2H3,(H,19,21).
What are the key properties of N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 108991479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).