N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide

C18H26N2O — CID 118472694

IUPACN-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide
SMILESCC1=CC(C)=C2C=C(C(=O)NC3CCCCC3)N(C)C2C1
InChIInChI=1S/C18H26N2O/c1-12-9-13(2)15-11-17(20(3)16(15)10-12)18(21)19-14-7-5-4-6-8-14/h9,11,14,16H,4-8,10H2,1-3H3,(H,19,21)
InChIKeyMFKFIAZDLBTPEX-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.30
Rot. Bonds2

About N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide

N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide (PubChem CID 118472694) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide
PubChem CID118472694
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide
SMILESCC1=CC(C)=C2C=C(C(=O)NC3CCCCC3)N(C)C2C1
InChIInChI=1S/C18H26N2O/c1-12-9-13(2)15-11-17(20(3)16(15)10-12)18(21)19-14-7-5-4-6-8-14/h9,11,14,16H,4-8,10H2,1-3H3,(H,19,21)
InChIKeyMFKFIAZDLBTPEX-UHFFFAOYSA-N
XLogP3.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide?
The IUPAC name of N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide (CID 118472694) is N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide?
The canonical SMILES for N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide is CC1=CC(C)=C2C=C(C(=O)NC3CCCCC3)N(C)C2C1.
What is the InChIKey of N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide?
The InChIKey is MFKFIAZDLBTPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-12-9-13(2)15-11-17(20(3)16(15)10-12)18(21)19-14-7-5-4-6-8-14/h9,11,14,16H,4-8,10H2,1-3H3,(H,19,21).
What are the key properties of N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide?
N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1,4,6-trimethyl-7,7a-dihydroindole-2-carboxamide is sourced from PubChem (CID 118472694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).