2-phenyl-N-(1-phenylethyl)aniline

C20H19N — CID 43078706

IUPAC2-phenyl-N-(1-phenylethyl)aniline
SMILESCC(Nc1ccccc1-c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19N/c1-16(17-10-4-2-5-11-17)21-20-15-9-8-14-19(20)18-12-6-3-7-13-18/h2-16,21H,1H3
InChIKeyMDKILHKGYUZSHQ-UHFFFAOYSA-N
MW273.38 g/mol
LogP5.53
Rot. Bonds4

About 2-phenyl-N-(1-phenylethyl)aniline

2-phenyl-N-(1-phenylethyl)aniline (PubChem CID 43078706) has the molecular formula C20H19N and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-phenyl-N-(1-phenylethyl)aniline.

Molecular Properties

Compound Name2-phenyl-N-(1-phenylethyl)aniline
PubChem CID43078706
Molecular FormulaC20H19N
Molecular Weight273.38 g/mol
Exact Mass273.15
IUPAC Name2-phenyl-N-(1-phenylethyl)aniline
SMILESCC(Nc1ccccc1-c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19N/c1-16(17-10-4-2-5-11-17)21-20-15-9-8-14-19(20)18-12-6-3-7-13-18/h2-16,21H,1H3
InChIKeyMDKILHKGYUZSHQ-UHFFFAOYSA-N
XLogP5.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.38
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-phenylanilino)propanenitrile
CID 54941632
2-bromo-N-[(1S)-1-phenylethyl]aniline;hydrochloride
CID 172882995
2-tert-butyl-N-(1-phenylethyl)aniline
CID 43226869
1-(2-phenylanilino)ethanesulfonic acid
CID 174617954
methyl 2-(2-phenylanilino)propanoate
CID 54941069
3-(2-phenylanilino)butanenitrile
CID 60913959
N-(1-phenylethyl)benzo[h]azulen-1-amine
CID 140974592
3-[[(1R)-1-phenylethyl]amino]cyclobut-3-ene-1,2-dione
CID 154184551
1-N,2-N-bis(2-phenylphenyl)benzene-1,2-diamine
CID 22968504
2,6-dichloro-N-(1-phenylethyl)aniline
CID 65467797
6-N-phenyl-4-N-(2-phenylphenyl)-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 118470770
2,4-dichloro-N-(1-phenylethyl)aniline
CID 43082155

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(1-phenylethyl)aniline?
The IUPAC name of 2-phenyl-N-(1-phenylethyl)aniline (CID 43078706) is 2-phenyl-N-(1-phenylethyl)aniline.
What is the SMILES notation for 2-phenyl-N-(1-phenylethyl)aniline?
The canonical SMILES for 2-phenyl-N-(1-phenylethyl)aniline is CC(Nc1ccccc1-c1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-(1-phenylethyl)aniline?
The InChIKey is MDKILHKGYUZSHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N/c1-16(17-10-4-2-5-11-17)21-20-15-9-8-14-19(20)18-12-6-3-7-13-18/h2-16,21H,1H3.
What are the key properties of 2-phenyl-N-(1-phenylethyl)aniline?
2-phenyl-N-(1-phenylethyl)aniline has a molecular weight of 273.38 g/mol, XLogP of 5.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(1-phenylethyl)aniline is sourced from PubChem (CID 43078706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).