2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine

C15H16ClN — CID 110282226

IUPAC2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(CCN)cc2)cc1Cl
InChIInChI=1S/C15H16ClN/c1-11-2-5-14(10-15(11)16)13-6-3-12(4-7-13)8-9-17/h2-7,10H,8-9,17H2,1H3
InChIKeyAJMFYNABPPOWNY-UHFFFAOYSA-N
MW245.75 g/mol
LogP3.82
Rot. Bonds3

About 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine

2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine (PubChem CID 110282226) has the molecular formula C15H16ClN and a molecular weight of 245.75 g/mol. Its IUPAC name is 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine
PubChem CID110282226
Molecular FormulaC15H16ClN
Molecular Weight245.75 g/mol
Exact Mass245.10
IUPAC Name2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(CCN)cc2)cc1Cl
InChIInChI=1S/C15H16ClN/c1-11-2-5-14(10-15(11)16)13-6-3-12(4-7-13)8-9-17/h2-7,10H,8-9,17H2,1H3
InChIKeyAJMFYNABPPOWNY-UHFFFAOYSA-N
XLogP3.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.75
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(3-chloro-4-fluorophenyl)phenyl]ethanamine
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2-[4-(2,6-dimethylphenyl)phenyl]ethanamine
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2-(4-chloro-3-methylphenyl)ethanamine;hydrochloride
CID 134085940
2-[4-chloro-3-(4-methylphenyl)phenyl]ethanamine
CID 115045738
methanamine;2-(4-methylphenyl)ethanamine
CID 144589082
[4-(2-aminoethyl)phenyl] N-(3-chloro-4-methylphenyl)carbamate
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[4-(3,4-dichlorophenyl)phenyl]methanamine
CID 3610827
5-(2-aminoethyl)-2-methylaniline
CID 58409288
2-[3-(4-methylphenyl)phenyl]ethanamine
CID 66523842
2-[3-(3-chloro-4-methylphenyl)pyrazol-1-yl]ethanamine;ethane
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CID 142897602
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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine?
The IUPAC name of 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine (CID 110282226) is 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine.
What is the SMILES notation for 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine?
The canonical SMILES for 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine is Cc1ccc(-c2ccc(CCN)cc2)cc1Cl.
What is the InChIKey of 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine?
The InChIKey is AJMFYNABPPOWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN/c1-11-2-5-14(10-15(11)16)13-6-3-12(4-7-13)8-9-17/h2-7,10H,8-9,17H2,1H3.
What are the key properties of 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine?
2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine has a molecular weight of 245.75 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-chloro-4-methylphenyl)phenyl]ethanamine is sourced from PubChem (CID 110282226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).