trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine

C21H19N — CID 56652646

IUPACtrans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine
SMILESN[C@H]1C[C@@H]1c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C21H19N/c22-21-14-20(21)19-12-10-18(11-13-19)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13,20-21H,14,22H2/t20-,21+/m1/s1
InChIKeyCMLZXDSPDMETRD-RTWAWAEBSA-N
MW285.39 g/mol
LogP4.84
Rot. Bonds3

About trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine

trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine (PubChem CID 56652646) has the molecular formula C21H19N and a molecular weight of 285.39 g/mol. Its IUPAC name is trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine.

Molecular Properties

Compound Nametrans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine
PubChem CID56652646
Molecular FormulaC21H19N
Molecular Weight285.39 g/mol
Exact Mass285.15
IUPAC Nametrans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine
SMILESN[C@H]1C[C@@H]1c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C21H19N/c22-21-14-20(21)19-12-10-18(11-13-19)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13,20-21H,14,22H2/t20-,21+/m1/s1
InChIKeyCMLZXDSPDMETRD-RTWAWAEBSA-N
XLogP4.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-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 trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine?
The IUPAC name of trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine (CID 56652646) is trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine.
What is the SMILES notation for trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine?
The canonical SMILES for trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine is N[C@H]1C[C@@H]1c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine?
The InChIKey is CMLZXDSPDMETRD-RTWAWAEBSA-N. The full InChI is InChI=1S/C21H19N/c22-21-14-20(21)19-12-10-18(11-13-19)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13,20-21H,14,22H2/t20-,21+/m1/s1.
What are the key properties of trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine?
trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine has a molecular weight of 285.39 g/mol, XLogP of 4.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2R)-2-[4-(4-phenylphenyl)phenyl]cyclopropan-1-amine is sourced from PubChem (CID 56652646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).