1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine

C19H25N — CID 64683038

IUPAC1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine
SMILESCCc1ccccc1CNC(C)c1ccc(C)c(C)c1
InChIInChI=1S/C19H25N/c1-5-17-8-6-7-9-19(17)13-20-16(4)18-11-10-14(2)15(3)12-18/h6-12,16,20H,5,13H2,1-4H3
InChIKeyZJOAKMMDAZLQKG-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.72
Rot. Bonds5

About 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine

1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine (PubChem CID 64683038) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine
PubChem CID64683038
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine
SMILESCCc1ccccc1CNC(C)c1ccc(C)c(C)c1
InChIInChI=1S/C19H25N/c1-5-17-8-6-7-9-19(17)13-20-16(4)18-11-10-14(2)15(3)12-18/h6-12,16,20H,5,13H2,1-4H3
InChIKeyZJOAKMMDAZLQKG-UHFFFAOYSA-N
XLogP4.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,4-dimethylphenyl)-N-(2-ethylsulfonylethyl)ethanamine
CID 103780942
N-[(2,5-dimethylphenyl)methyl]-1-phenylethanamine
CID 60684201
(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-3-ylethanamine
CID 81406474
(1R)-1-(3-bromophenyl)-N-[(2-methylphenyl)methyl]ethanamine
CID 81371674
1-(4-ethylphenyl)-N-[(2,4,5-trimethylphenyl)methyl]ethanamine
CID 43221514
N-[1-(3,4-dimethylphenyl)ethyl]octan-1-amine
CID 115566559
N-[(2-fluorophenyl)methyl]-1-(4-methyl-3-nitrophenyl)ethanamine
CID 43201422
1-(3,4-dimethylphenyl)-N-(2-ethylsulfinylethyl)ethanamine
CID 115718870
1-(4-fluoro-3-methoxyphenyl)-N-[(2-methylphenyl)methyl]ethanamine
CID 82884552
N-[1-(3,4-dimethylphenyl)ethyl]-2,2-difluoroethanamine
CID 115405623
(1S)-1-(3-chlorophenyl)-N-[(2-methylphenyl)methyl]ethanamine
CID 29276650
(1S)-N-[(2-bromophenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81363977

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine?
The IUPAC name of 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine (CID 64683038) is 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine?
The canonical SMILES for 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine is CCc1ccccc1CNC(C)c1ccc(C)c(C)c1.
What is the InChIKey of 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine?
The InChIKey is ZJOAKMMDAZLQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-5-17-8-6-7-9-19(17)13-20-16(4)18-11-10-14(2)15(3)12-18/h6-12,16,20H,5,13H2,1-4H3.
What are the key properties of 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine?
1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine has a molecular weight of 267.42 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-N-[(2-ethylphenyl)methyl]ethanamine is sourced from PubChem (CID 64683038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).