2-(3-chlorophenyl)-5-phenylpentan-2-amine

C17H20ClN — CID 55095968

IUPAC2-(3-chlorophenyl)-5-phenylpentan-2-amine
SMILESCC(N)(CCCc1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C17H20ClN/c1-17(19,15-10-5-11-16(18)13-15)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11,13H,6,9,12,19H2,1H3
InChIKeyCTGLSAWOKZSUMO-UHFFFAOYSA-N
MW273.81 g/mol
LogP4.54
Rot. Bonds5

About 2-(3-chlorophenyl)-5-phenylpentan-2-amine

2-(3-chlorophenyl)-5-phenylpentan-2-amine (PubChem CID 55095968) has the molecular formula C17H20ClN and a molecular weight of 273.81 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-5-phenylpentan-2-amine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-5-phenylpentan-2-amine
PubChem CID55095968
Molecular FormulaC17H20ClN
Molecular Weight273.81 g/mol
Exact Mass273.13
IUPAC Name2-(3-chlorophenyl)-5-phenylpentan-2-amine
SMILESCC(N)(CCCc1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C17H20ClN/c1-17(19,15-10-5-11-16(18)13-15)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11,13H,6,9,12,19H2,1H3
InChIKeyCTGLSAWOKZSUMO-UHFFFAOYSA-N
XLogP4.54
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.81
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-ethylphenyl)-5-phenylpentan-2-amine
CID 63408465
2-(2-chlorophenyl)-5-phenylpentan-2-amine
CID 62621449
3-amino-3-(3-chlorophenyl)butanoic acid
CID 64664943
5-(3-tert-butylphenyl)-2-fluoropentan-2-amine
CID 70646222
2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine
CID 104735876
2-(3-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-amine
CID 63408099
4-(3-chlorophenyl)-4,4-diphenylbutan-1-amine
CID 57326677
(2S)-2-phenylhexan-2-amine
CID 10889241
2-(3-chlorophenyl)-2-methyl-3-phenylpropanenitrile
CID 117048203
1-chloro-3-(1,1-dibromoethyl)benzene
CID 15877621
(5-chloro-4,4-dimethylpentyl)benzene
CID 66059754
(2-methyl-6-phenylhexan-2-yl)benzene
CID 57113008

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-5-phenylpentan-2-amine?
The IUPAC name of 2-(3-chlorophenyl)-5-phenylpentan-2-amine (CID 55095968) is 2-(3-chlorophenyl)-5-phenylpentan-2-amine.
What is the SMILES notation for 2-(3-chlorophenyl)-5-phenylpentan-2-amine?
The canonical SMILES for 2-(3-chlorophenyl)-5-phenylpentan-2-amine is CC(N)(CCCc1ccccc1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-5-phenylpentan-2-amine?
The InChIKey is CTGLSAWOKZSUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN/c1-17(19,15-10-5-11-16(18)13-15)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11,13H,6,9,12,19H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-5-phenylpentan-2-amine?
2-(3-chlorophenyl)-5-phenylpentan-2-amine has a molecular weight of 273.81 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-5-phenylpentan-2-amine is sourced from PubChem (CID 55095968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).