N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine

C19H24FN — CID 81269079

IUPACN-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(F)cc1C)c1cc(C)c(C)cc1C
InChIInChI=1S/C19H24FN/c1-6-21-19(17-8-7-16(20)10-15(17)5)18-11-13(3)12(2)9-14(18)4/h7-11,19,21H,6H2,1-5H3
InChIKeyBRJRIDNEMNBKGV-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.76
Rot. Bonds4

About N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine

N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine (PubChem CID 81269079) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine
PubChem CID81269079
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC NameN-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(F)cc1C)c1cc(C)c(C)cc1C
InChIInChI=1S/C19H24FN/c1-6-21-19(17-8-7-16(20)10-15(17)5)18-11-13(3)12(2)9-14(18)4/h7-11,19,21H,6H2,1-5H3
InChIKeyBRJRIDNEMNBKGV-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(5-bromo-2-methylphenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 115852352
N-[(3,5-difluorophenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 62790553
N-[(2-ethylphenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 115852479
N-[(2-fluoro-3-methoxyphenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 82791652
N-[(2-chloro-4,5-dimethylphenyl)-(2-chloro-4-fluorophenyl)methyl]ethanamine
CID 115484037
N-[(4-fluoro-2-methylphenyl)-(4-propan-2-ylphenyl)methyl]ethanamine
CID 63412127
N-[(2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine
CID 64989694
[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105256714
N-[(3-bromo-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 106645960
N-[(3-chloro-4-methylphenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 115852524
N-[(2-chlorophenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine
CID 64989854
N-[(3-bromo-5-methylphenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 115852310

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine?
The IUPAC name of N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine (CID 81269079) is N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine is CCNC(c1ccc(F)cc1C)c1cc(C)c(C)cc1C.
What is the InChIKey of N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine?
The InChIKey is BRJRIDNEMNBKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-6-21-19(17-8-7-16(20)10-15(17)5)18-11-13(3)12(2)9-14(18)4/h7-11,19,21H,6H2,1-5H3.
What are the key properties of N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine?
N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine has a molecular weight of 285.41 g/mol, XLogP of 4.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methyl]ethanamine is sourced from PubChem (CID 81269079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).