3H-inden-1-amine

C9H9N — CID 21343725

IUPAC3H-inden-1-amine
SMILESNC1=CCc2ccccc21
InChIInChI=1S/C9H9N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5,10H2
InChIKeyCCSXSLXIPVQFMN-UHFFFAOYSA-N
MW131.18 g/mol
LogP1.54
Rot. Bonds

About 3H-inden-1-amine

3H-inden-1-amine (PubChem CID 21343725) has the molecular formula C9H9N and a molecular weight of 131.18 g/mol. Its IUPAC name is 3H-inden-1-amine.

Molecular Properties

Compound Name3H-inden-1-amine
PubChem CID21343725
Molecular FormulaC9H9N
Molecular Weight131.18 g/mol
Exact Mass131.07
IUPAC Name3H-inden-1-amine
SMILESNC1=CCc2ccccc21
InChIInChI=1S/C9H9N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5,10H2
InChIKeyCCSXSLXIPVQFMN-UHFFFAOYSA-N
XLogP1.54
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3H-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 3H-inden-1-amine?
The IUPAC name of 3H-inden-1-amine (CID 21343725) is 3H-inden-1-amine.
What is the SMILES notation for 3H-inden-1-amine?
The canonical SMILES for 3H-inden-1-amine is NC1=CCc2ccccc21.
What is the InChIKey of 3H-inden-1-amine?
The InChIKey is CCSXSLXIPVQFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5,10H2.
What are the key properties of 3H-inden-1-amine?
3H-inden-1-amine has a molecular weight of 131.18 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-inden-1-amine is sourced from PubChem (CID 21343725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).