1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride

C23H24ClN — CID 70058981

IUPAC1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride
SMILESCl.NC1Cc2ccccc2C1Cc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C23H23N.ClH/c24-23-16-20-8-4-5-9-21(20)22(23)15-19-12-10-18(11-13-19)14-17-6-2-1-3-7-17;/h1-13,22-23H,14-16,24H2;1H
InChIKeySTMQVDUOSAWVMW-UHFFFAOYSA-N
MW349.91 g/mol
LogP4.91
Rot. Bonds4

About 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride

1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride (PubChem CID 70058981) has the molecular formula C23H24ClN and a molecular weight of 349.91 g/mol. Its IUPAC name is 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride.

Molecular Properties

Compound Name1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride
PubChem CID70058981
Molecular FormulaC23H24ClN
Molecular Weight349.91 g/mol
Exact Mass349.16
IUPAC Name1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride
SMILESCl.NC1Cc2ccccc2C1Cc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C23H23N.ClH/c24-23-16-20-8-4-5-9-21(20)22(23)15-19-12-10-18(11-13-19)14-17-6-2-1-3-7-17;/h1-13,22-23H,14-16,24H2;1H
InChIKeySTMQVDUOSAWVMW-UHFFFAOYSA-N
XLogP4.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.91
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride 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-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The IUPAC name of 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride (CID 70058981) is 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride.
What is the SMILES notation for 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The canonical SMILES for 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride is Cl.NC1Cc2ccccc2C1Cc1ccc(Cc2ccccc2)cc1.
What is the InChIKey of 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The InChIKey is STMQVDUOSAWVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N.ClH/c24-23-16-20-8-4-5-9-21(20)22(23)15-19-12-10-18(11-13-19)14-17-6-2-1-3-7-17;/h1-13,22-23H,14-16,24H2;1H.
What are the key properties of 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride?
1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride has a molecular weight of 349.91 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-benzylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine;hydrochloride is sourced from PubChem (CID 70058981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).