N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine

C14H21N — CID 63823005

IUPACN-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(CC(C)C)c2ccccc21
InChIInChI=1S/C14H21N/c1-10(2)8-11-9-14(15-3)13-7-5-4-6-12(11)13/h4-7,10-11,14-15H,8-9H2,1-3H3
InChIKeyKYWSIWJOPKCWLK-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.48
Rot. Bonds3

About N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine

N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 63823005) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID63823005
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(CC(C)C)c2ccccc21
InChIInChI=1S/C14H21N/c1-10(2)8-11-9-14(15-3)13-7-5-4-6-12(11)13/h4-7,10-11,14-15H,8-9H2,1-3H3
InChIKeyKYWSIWJOPKCWLK-UHFFFAOYSA-N
XLogP3.48
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-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-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine (CID 63823005) is N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine is CNC1CC(CC(C)C)c2ccccc21.
What is the InChIKey of N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KYWSIWJOPKCWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10(2)8-11-9-14(15-3)13-7-5-4-6-12(11)13/h4-7,10-11,14-15H,8-9H2,1-3H3.
What are the key properties of N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine?
N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 63823005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).