N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine

C18H23N — CID 43491470

IUPACN-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)c1cccc(C)c1
InChIInChI=1S/C18H23N/c1-4-15-9-11-16(12-10-15)18(19-5-2)17-8-6-7-14(3)13-17/h6-13,18-19H,4-5H2,1-3H3
InChIKeyZBDQFYLBAKYSAU-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.26
Rot. Bonds5

About N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine

N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine (PubChem CID 43491470) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine
PubChem CID43491470
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)c1cccc(C)c1
InChIInChI=1S/C18H23N/c1-4-15-9-11-16(12-10-15)18(19-5-2)17-8-6-7-14(3)13-17/h6-13,18-19H,4-5H2,1-3H3
InChIKeyZBDQFYLBAKYSAU-UHFFFAOYSA-N
XLogP4.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[bis(4-ethylphenyl)methyl]ethanamine
CID 43491437
N-[(3-bromo-4-chlorophenyl)-(3-methylphenyl)methyl]ethanamine
CID 115567422
N-[(3,4-dimethoxyphenyl)-(3-methylphenyl)methyl]ethanamine
CID 43488776
N-[(3,4-dichlorophenyl)-(4-ethylphenyl)methyl]ethanamine
CID 43491461
N-[(3-methoxyphenyl)-(3-methylphenyl)methyl]ethanamine
CID 60797781
N-[(2,4-dimethylphenyl)-(4-ethylphenyl)methyl]ethanamine
CID 43489966
N-[(5-methylfuran-3-yl)-(3-methylphenyl)methyl]ethanamine
CID 115790238
N-[(4-bromo-3,5-dimethylphenyl)-(4-ethylphenyl)methyl]ethanamine
CID 114330651
(1S)-N-[(4-ethylphenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81361545
(1R)-N-[(4-ethylphenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81364360
N-[(4-ethylphenyl)-(4-methyl-2-pyridinyl)methyl]ethanamine
CID 63840683
N-[(4-fluoro-3-methoxyphenyl)-(3-methylphenyl)methyl]ethanamine
CID 115790055

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine?
The IUPAC name of N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine (CID 43491470) is N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine is CCNC(c1ccc(CC)cc1)c1cccc(C)c1.
What is the InChIKey of N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine?
The InChIKey is ZBDQFYLBAKYSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-4-15-9-11-16(12-10-15)18(19-5-2)17-8-6-7-14(3)13-17/h6-13,18-19H,4-5H2,1-3H3.
What are the key properties of N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine?
N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine has a molecular weight of 253.39 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 43491470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).