N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine

C19H29N — CID 107849963

IUPACN-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(C)CC1CCCC(NC2Cc3ccccc3C2)C1
InChIInChI=1S/C19H29N/c1-14(2)10-15-6-5-9-18(11-15)20-19-12-16-7-3-4-8-17(16)13-19/h3-4,7-8,14-15,18-20H,5-6,9-13H2,1-2H3
InChIKeyVNQDKMABWWLVIZ-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.35
Rot. Bonds4

About N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine

N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 107849963) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID107849963
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC NameN-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(C)CC1CCCC(NC2Cc3ccccc3C2)C1
InChIInChI=1S/C19H29N/c1-14(2)10-15-6-5-9-18(11-15)20-19-12-16-7-3-4-8-17(16)13-19/h3-4,7-8,14-15,18-20H,5-6,9-13H2,1-2H3
InChIKeyVNQDKMABWWLVIZ-UHFFFAOYSA-N
XLogP4.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine 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-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine (CID 107849963) is N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine is CC(C)CC1CCCC(NC2Cc3ccccc3C2)C1.
What is the InChIKey of N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is VNQDKMABWWLVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-14(2)10-15-6-5-9-18(11-15)20-19-12-16-7-3-4-8-17(16)13-19/h3-4,7-8,14-15,18-20H,5-6,9-13H2,1-2H3.
What are the key properties of N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine?
N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 271.45 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpropyl)cyclohexyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 107849963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).