2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine

C19H24N2 — CID 83210816

IUPAC2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine
SMILESCNC1CCCc2cn(Cc3ccc4c(c3)CCC4)cc21
InChIInChI=1S/C19H24N2/c1-20-19-7-3-6-17-12-21(13-18(17)19)11-14-8-9-15-4-2-5-16(15)10-14/h8-10,12-13,19-20H,2-7,11H2,1H3
InChIKeyLMEIGVKTXMZBSP-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.62
Rot. Bonds3

About 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine

2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine (PubChem CID 83210816) has the molecular formula C19H24N2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine
PubChem CID83210816
Molecular FormulaC19H24N2
Molecular Weight280.41 g/mol
Exact Mass280.19
IUPAC Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine
SMILESCNC1CCCc2cn(Cc3ccc4c(c3)CCC4)cc21
InChIInChI=1S/C19H24N2/c1-20-19-7-3-6-17-12-21(13-18(17)19)11-14-8-9-15-4-2-5-16(15)10-14/h8-10,12-13,19-20H,2-7,11H2,1H3
InChIKeyLMEIGVKTXMZBSP-UHFFFAOYSA-N
XLogP3.62
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-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 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine (CID 83210816) is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine is CNC1CCCc2cn(Cc3ccc4c(c3)CCC4)cc21.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine?
The InChIKey is LMEIGVKTXMZBSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-20-19-7-3-6-17-12-21(13-18(17)19)11-14-8-9-15-4-2-5-16(15)10-14/h8-10,12-13,19-20H,2-7,11H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine?
2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine has a molecular weight of 280.41 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine is sourced from PubChem (CID 83210816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).