1,2-diphenylethanamine

C14H15N — CID 26482

IUPAC1,2-diphenylethanamine
SMILESNC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2
InChIKeyDTGGNTMERRTPLR-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.93
Rot. Bonds3

About 1,2-diphenylethanamine

1,2-diphenylethanamine (PubChem CID 26482) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is 1,2-diphenylethanamine.

Molecular Properties

Compound Name1,2-diphenylethanamine
PubChem CID26482
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name1,2-diphenylethanamine
SMILESNC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2
InChIKeyDTGGNTMERRTPLR-UHFFFAOYSA-N
XLogP2.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylethanamine?
The IUPAC name of 1,2-diphenylethanamine (CID 26482) is 1,2-diphenylethanamine.
What is the SMILES notation for 1,2-diphenylethanamine?
The canonical SMILES for 1,2-diphenylethanamine is NC(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1,2-diphenylethanamine?
The InChIKey is DTGGNTMERRTPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2.
What are the key properties of 1,2-diphenylethanamine?
1,2-diphenylethanamine has a molecular weight of 197.28 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylethanamine is sourced from PubChem (CID 26482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).