1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine

C13H19N — CID 57461970

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C13H19N/c1-10(14-2)8-11-6-7-12-4-3-5-13(12)9-11/h6-7,9-10,14H,3-5,8H2,1-2H3
InChIKeyMHBKJTHGGWQKSG-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.33
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine

1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine (PubChem CID 57461970) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine
PubChem CID57461970
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C13H19N/c1-10(14-2)8-11-6-7-12-4-3-5-13(12)9-11/h6-7,9-10,14H,3-5,8H2,1-2H3
InChIKeyMHBKJTHGGWQKSG-UHFFFAOYSA-N
XLogP2.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-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 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine (CID 57461970) is 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine is CNC(C)Cc1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine?
The InChIKey is MHBKJTHGGWQKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-10(14-2)8-11-6-7-12-4-3-5-13(12)9-11/h6-7,9-10,14H,3-5,8H2,1-2H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine?
1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 57461970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).