1-(2,4,5-trimethylphenyl)ethenamine

C11H15N — CID 134277556

IUPAC1-(2,4,5-trimethylphenyl)ethenamine
SMILESC=C(N)c1cc(C)c(C)cc1C
InChIInChI=1S/C11H15N/c1-7-5-9(3)11(10(4)12)6-8(7)2/h5-6H,4,12H2,1-3H3
InChIKeyUERMDGRNBJSMHH-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.54
Rot. Bonds1

About 1-(2,4,5-trimethylphenyl)ethenamine

1-(2,4,5-trimethylphenyl)ethenamine (PubChem CID 134277556) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 1-(2,4,5-trimethylphenyl)ethenamine.

Molecular Properties

Compound Name1-(2,4,5-trimethylphenyl)ethenamine
PubChem CID134277556
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name1-(2,4,5-trimethylphenyl)ethenamine
SMILESC=C(N)c1cc(C)c(C)cc1C
InChIInChI=1S/C11H15N/c1-7-5-9(3)11(10(4)12)6-8(7)2/h5-6H,4,12H2,1-3H3
InChIKeyUERMDGRNBJSMHH-UHFFFAOYSA-N
XLogP2.54
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(3,3-dimethylbut-1-en-2-yl)-2,4,5-trimethylbenzene
CID 100987679
ethane;2-methylprop-1-ene;1,2,4,5-tetramethylbenzene
CID 166473604
1,2,4-trimethyl-5-[1-(2,4,6-trimethylphenyl)ethenyl]benzene
CID 102082358
1-hex-1-en-2-yl-2,4,5-trimethylbenzene
CID 142349579
4-(1-aminoethenyl)-2-methyl-5-[(Z)-prop-1-enyl]phenol
CID 142012265
2,4,5-trimethylbenzenecarbothioyl chloride
CID 150447930
2,4-dimethyl-5-prop-1-en-2-ylaniline;ethane
CID 177043564
3-amino-1-(2,4,5-trimethylphenyl)propan-1-one
CID 82281454
1-[2-methyl-5-(2-methyl-4-pyridinyl)phenyl]ethenamine
CID 146539570
methane;1,2,4,5-tetramethylbenzene
CID 162125793

Frequently Asked Questions

What is the IUPAC name of 1-(2,4,5-trimethylphenyl)ethenamine?
The IUPAC name of 1-(2,4,5-trimethylphenyl)ethenamine (CID 134277556) is 1-(2,4,5-trimethylphenyl)ethenamine.
What is the SMILES notation for 1-(2,4,5-trimethylphenyl)ethenamine?
The canonical SMILES for 1-(2,4,5-trimethylphenyl)ethenamine is C=C(N)c1cc(C)c(C)cc1C.
What is the InChIKey of 1-(2,4,5-trimethylphenyl)ethenamine?
The InChIKey is UERMDGRNBJSMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-7-5-9(3)11(10(4)12)6-8(7)2/h5-6H,4,12H2,1-3H3.
What are the key properties of 1-(2,4,5-trimethylphenyl)ethenamine?
1-(2,4,5-trimethylphenyl)ethenamine has a molecular weight of 161.25 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4,5-trimethylphenyl)ethenamine is sourced from PubChem (CID 134277556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).