N-benzhydryl-1-phenylpropan-2-amine

C22H23N — CID 50903543

IUPACN-benzhydryl-1-phenylpropan-2-amine
SMILESCC(Cc1ccccc1)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H23N/c1-18(17-19-11-5-2-6-12-19)23-22(20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22-23H,17H2,1H3
InChIKeyVBMLMDFCZULTDN-UHFFFAOYSA-N
MW301.43 g/mol
LogP5.00
Rot. Bonds6

About N-benzhydryl-1-phenylpropan-2-amine

N-benzhydryl-1-phenylpropan-2-amine (PubChem CID 50903543) has the molecular formula C22H23N and a molecular weight of 301.43 g/mol. Its IUPAC name is N-benzhydryl-1-phenylpropan-2-amine.

Molecular Properties

Compound NameN-benzhydryl-1-phenylpropan-2-amine
PubChem CID50903543
Molecular FormulaC22H23N
Molecular Weight301.43 g/mol
Exact Mass301.18
IUPAC NameN-benzhydryl-1-phenylpropan-2-amine
SMILESCC(Cc1ccccc1)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H23N/c1-18(17-19-11-5-2-6-12-19)23-22(20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22-23H,17H2,1H3
InChIKeyVBMLMDFCZULTDN-UHFFFAOYSA-N
XLogP5.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-benzhydryl-1-phenylpropan-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 N-benzhydryl-1-phenylpropan-2-amine?
The IUPAC name of N-benzhydryl-1-phenylpropan-2-amine (CID 50903543) is N-benzhydryl-1-phenylpropan-2-amine.
What is the SMILES notation for N-benzhydryl-1-phenylpropan-2-amine?
The canonical SMILES for N-benzhydryl-1-phenylpropan-2-amine is CC(Cc1ccccc1)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-1-phenylpropan-2-amine?
The InChIKey is VBMLMDFCZULTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N/c1-18(17-19-11-5-2-6-12-19)23-22(20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22-23H,17H2,1H3.
What are the key properties of N-benzhydryl-1-phenylpropan-2-amine?
N-benzhydryl-1-phenylpropan-2-amine has a molecular weight of 301.43 g/mol, XLogP of 5.00, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-1-phenylpropan-2-amine is sourced from PubChem (CID 50903543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).