1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine

C18H23N — CID 54863165

IUPAC1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
SMILESCc1ccc(C(C)NC(C)c2cccc(C)c2)cc1
InChIInChI=1S/C18H23N/c1-13-8-10-17(11-9-13)15(3)19-16(4)18-7-5-6-14(2)12-18/h5-12,15-16,19H,1-4H3
InChIKeyDKHPZAWZEPMYMT-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.72
Rot. Bonds4

About 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine

1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine (PubChem CID 54863165) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
PubChem CID54863165
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
SMILESCc1ccc(C(C)NC(C)c2cccc(C)c2)cc1
InChIInChI=1S/C18H23N/c1-13-8-10-17(11-9-13)15(3)19-16(4)18-7-5-6-14(2)12-18/h5-12,15-16,19H,1-4H3
InChIKeyDKHPZAWZEPMYMT-UHFFFAOYSA-N
XLogP4.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-N-[1-(3-methylphenyl)ethyl]-1-phenylethanamine
CID 79040987
(1R)-1-(4-fluorophenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
CID 81350639
1-(4-fluorophenyl)-N-[(1S)-1-(3-methylphenyl)ethyl]ethanamine
CID 81363847
(1S)-1-(4-fluorophenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine
CID 81347759
N-[(1R)-1-(3-chlorophenyl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81366687
N-[(1S)-1-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81376233
(1S)-1-(3-methylphenyl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
CID 81367068
3-[1-[[(1S)-1-(3-methylphenyl)ethyl]amino]ethyl]benzonitrile
CID 81364071
N-[(1R)-1-(2-bromophenyl)ethyl]-1-(3-methylphenyl)ethanamine
CID 81378602
2-methoxy-4-[1-[[(1S)-1-(3-methylphenyl)ethyl]amino]ethyl]phenol
CID 81367090
ethane;bis(1-methyl-3-propan-2-ylbenzene);bis(1-methyl-4-propan-2-ylbenzene)
CID 158672688
[1-(3-methylphenyl)ethylamino]methanolate
CID 163854725

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine?
The IUPAC name of 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine (CID 54863165) is 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine.
What is the SMILES notation for 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine?
The canonical SMILES for 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine is Cc1ccc(C(C)NC(C)c2cccc(C)c2)cc1.
What is the InChIKey of 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine?
The InChIKey is DKHPZAWZEPMYMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-13-8-10-17(11-9-13)15(3)19-16(4)18-7-5-6-14(2)12-18/h5-12,15-16,19H,1-4H3.
What are the key properties of 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine?
1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine has a molecular weight of 253.39 g/mol, XLogP of 4.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-N-[1-(3-methylphenyl)ethyl]ethanamine is sourced from PubChem (CID 54863165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).