(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine

C15H16ClN — CID 43198498

IUPAC(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
SMILESCc1ccc(C(N)c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C15H16ClN/c1-10-3-8-14(11(2)9-10)15(17)12-4-6-13(16)7-5-12/h3-9,15H,17H2,1-2H3
InChIKeyHIGVAOUWJRLCFI-UHFFFAOYSA-N
MW245.75 g/mol
LogP4.00
Rot. Bonds2

About (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine

(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine (PubChem CID 43198498) has the molecular formula C15H16ClN and a molecular weight of 245.75 g/mol. Its IUPAC name is (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine.

Molecular Properties

Compound Name(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
PubChem CID43198498
Molecular FormulaC15H16ClN
Molecular Weight245.75 g/mol
Exact Mass245.10
IUPAC Name(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
SMILESCc1ccc(C(N)c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C15H16ClN/c1-10-3-8-14(11(2)9-10)15(17)12-4-6-13(16)7-5-12/h3-9,15H,17H2,1-2H3
InChIKeyHIGVAOUWJRLCFI-UHFFFAOYSA-N
XLogP4.00
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.75
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,5-dichlorophenyl)-(2,4-dimethylphenyl)methanamine
CID 43096001
(2,4-dimethylphenyl)-(4-fluoro-3-methylphenyl)methanamine
CID 62801842
(3-bromo-4-fluorophenyl)-(2,4-dimethylphenyl)methanamine
CID 79746589
(3-bromo-4-chlorophenyl)-(2,4-dimethylphenyl)methanamine
CID 113337076
(5-chloro-2-methylphenyl)-(4-chlorophenyl)methanamine
CID 79016195
(2,4-dimethylphenyl)-(4-ethoxyphenyl)methanamine
CID 43197133
(1R)-1-(4-chlorophenyl)-N-[1-(2,4-dimethylphenyl)ethyl]ethanamine
CID 81352684
(4-tert-butylphenyl)-(2-chloro-4-methylphenyl)methanamine
CID 106857421
(2-fluoro-5-methylphenyl)-(4-propan-2-ylphenyl)methanamine
CID 62514124
(2,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
CID 43198537
(2-chloro-4-fluoro-5-methylphenyl)-(2,4-dimethylphenyl)methanamine
CID 81045582
(R)-(4-chloro-2-methylphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171250333

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine?
The IUPAC name of (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine (CID 43198498) is (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine.
What is the SMILES notation for (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine?
The canonical SMILES for (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine is Cc1ccc(C(N)c2ccc(Cl)cc2)c(C)c1.
What is the InChIKey of (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine?
The InChIKey is HIGVAOUWJRLCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN/c1-10-3-8-14(11(2)9-10)15(17)12-4-6-13(16)7-5-12/h3-9,15H,17H2,1-2H3.
What are the key properties of (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine?
(4-chlorophenyl)-(2,4-dimethylphenyl)methanamine has a molecular weight of 245.75 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(2,4-dimethylphenyl)methanamine is sourced from PubChem (CID 43198498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).