1-(3H-inden-1-yl)-N-methylmethanamine

C11H13N — CID 105431281

IUPAC1-(3H-inden-1-yl)-N-methylmethanamine
SMILESCNCC1=CCc2ccccc21
InChIInChI=1S/C11H13N/c1-12-8-10-7-6-9-4-2-3-5-11(9)10/h2-5,7,12H,6,8H2,1H3
InChIKeyXISOHWSGQPZCGO-UHFFFAOYSA-N
MW159.23 g/mol
LogP1.85
Rot. Bonds2

About 1-(3H-inden-1-yl)-N-methylmethanamine

1-(3H-inden-1-yl)-N-methylmethanamine (PubChem CID 105431281) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 1-(3H-inden-1-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3H-inden-1-yl)-N-methylmethanamine
PubChem CID105431281
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name1-(3H-inden-1-yl)-N-methylmethanamine
SMILESCNCC1=CCc2ccccc21
InChIInChI=1S/C11H13N/c1-12-8-10-7-6-9-4-2-3-5-11(9)10/h2-5,7,12H,6,8H2,1H3
InChIKeyXISOHWSGQPZCGO-UHFFFAOYSA-N
XLogP1.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(3H-inden-1-yl)-N-methylmethanamine 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-(3H-inden-1-yl)-N-methylmethanamine?
The IUPAC name of 1-(3H-inden-1-yl)-N-methylmethanamine (CID 105431281) is 1-(3H-inden-1-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3H-inden-1-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3H-inden-1-yl)-N-methylmethanamine is CNCC1=CCc2ccccc21.
What is the InChIKey of 1-(3H-inden-1-yl)-N-methylmethanamine?
The InChIKey is XISOHWSGQPZCGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-12-8-10-7-6-9-4-2-3-5-11(9)10/h2-5,7,12H,6,8H2,1H3.
What are the key properties of 1-(3H-inden-1-yl)-N-methylmethanamine?
1-(3H-inden-1-yl)-N-methylmethanamine has a molecular weight of 159.23 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-inden-1-yl)-N-methylmethanamine is sourced from PubChem (CID 105431281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).