N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide

C17H24N2O — CID 60938543

IUPACN-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C17H24N2O/c1-12-5-3-4-6-16(12)19(2)17(20)14-7-8-15-13(11-14)9-10-18-15/h7-8,11-12,16,18H,3-6,9-10H2,1-2H3
InChIKeyRNUZPFRDFKOZFC-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.31
Rot. Bonds2

About N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide

N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 60938543) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID60938543
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C17H24N2O/c1-12-5-3-4-6-16(12)19(2)17(20)14-7-8-15-13(11-14)9-10-18-15/h7-8,11-12,16,18H,3-6,9-10H2,1-2H3
InChIKeyRNUZPFRDFKOZFC-UHFFFAOYSA-N
XLogP3.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide (CID 60938543) is N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide is CC1CCCCC1N(C)C(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is RNUZPFRDFKOZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-12-5-3-4-6-16(12)19(2)17(20)14-7-8-15-13(11-14)9-10-18-15/h7-8,11-12,16,18H,3-6,9-10H2,1-2H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide?
N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 60938543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).