(1R)-N-benzhydryl-1-phenylethanamine

C21H21N — CID 14814265

IUPAC(1R)-N-benzhydryl-1-phenylethanamine
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17,21-22H,1H3/t17-/m1/s1
InChIKeyUCYIHJQWJSWWEQ-QGZVFWFLSA-N
MW287.41 g/mol
LogP5.13
Rot. Bonds5

About (1R)-N-benzhydryl-1-phenylethanamine

(1R)-N-benzhydryl-1-phenylethanamine (PubChem CID 14814265) has the molecular formula C21H21N and a molecular weight of 287.41 g/mol. Its IUPAC name is (1R)-N-benzhydryl-1-phenylethanamine.

Molecular Properties

Compound Name(1R)-N-benzhydryl-1-phenylethanamine
PubChem CID14814265
Molecular FormulaC21H21N
Molecular Weight287.41 g/mol
Exact Mass287.17
IUPAC Name(1R)-N-benzhydryl-1-phenylethanamine
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17,21-22H,1H3/t17-/m1/s1
InChIKeyUCYIHJQWJSWWEQ-QGZVFWFLSA-N
XLogP5.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.41
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-benzhydryl-1-phenylethanamine?
The IUPAC name of (1R)-N-benzhydryl-1-phenylethanamine (CID 14814265) is (1R)-N-benzhydryl-1-phenylethanamine.
What is the SMILES notation for (1R)-N-benzhydryl-1-phenylethanamine?
The canonical SMILES for (1R)-N-benzhydryl-1-phenylethanamine is C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (1R)-N-benzhydryl-1-phenylethanamine?
The InChIKey is UCYIHJQWJSWWEQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H21N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17,21-22H,1H3/t17-/m1/s1.
What are the key properties of (1R)-N-benzhydryl-1-phenylethanamine?
(1R)-N-benzhydryl-1-phenylethanamine has a molecular weight of 287.41 g/mol, XLogP of 5.13, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-benzhydryl-1-phenylethanamine is sourced from PubChem (CID 14814265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).