1-phenyl-N-[(1R)-1-phenylethyl]ethanimine

C16H17N — CID 10987878

IUPAC1-phenyl-N-[(1R)-1-phenylethyl]ethanimine
SMILESC/C(=N\[C@H](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-13H,1-2H3/b17-14+/t13-/m1/s1
InChIKeyHXVFIDKQGMXDOK-UDIPDBSGSA-N
MW223.32 g/mol
LogP4.26
Rot. Bonds3

About 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine

1-phenyl-N-[(1R)-1-phenylethyl]ethanimine (PubChem CID 10987878) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine.

Molecular Properties

Compound Name1-phenyl-N-[(1R)-1-phenylethyl]ethanimine
PubChem CID10987878
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name1-phenyl-N-[(1R)-1-phenylethyl]ethanimine
SMILESC/C(=N\[C@H](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-13H,1-2H3/b17-14+/t13-/m1/s1
InChIKeyHXVFIDKQGMXDOK-UDIPDBSGSA-N
XLogP4.26
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine 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-phenyl-N-[(1R)-1-phenylethyl]ethanimine?
The IUPAC name of 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine (CID 10987878) is 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine.
What is the SMILES notation for 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine?
The canonical SMILES for 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine is C/C(=N\[C@H](C)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine?
The InChIKey is HXVFIDKQGMXDOK-UDIPDBSGSA-N. The full InChI is InChI=1S/C16H17N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-13H,1-2H3/b17-14+/t13-/m1/s1.
What are the key properties of 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine?
1-phenyl-N-[(1R)-1-phenylethyl]ethanimine has a molecular weight of 223.32 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(1R)-1-phenylethyl]ethanimine is sourced from PubChem (CID 10987878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).