1-(2-ethylphenyl)-2-methylpropan-1-amine

C12H19N — CID 55283279

IUPAC1-(2-ethylphenyl)-2-methylpropan-1-amine
SMILESCCc1ccccc1C(N)C(C)C
InChIInChI=1S/C12H19N/c1-4-10-7-5-6-8-11(10)12(13)9(2)3/h5-9,12H,4,13H2,1-3H3
InChIKeyFYGOLUMGQJWCMY-UHFFFAOYSA-N
MW177.29 g/mol
LogP2.90
Rot. Bonds3

About 1-(2-ethylphenyl)-2-methylpropan-1-amine

1-(2-ethylphenyl)-2-methylpropan-1-amine (PubChem CID 55283279) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2-ethylphenyl)-2-methylpropan-1-amine
PubChem CID55283279
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name1-(2-ethylphenyl)-2-methylpropan-1-amine
SMILESCCc1ccccc1C(N)C(C)C
InChIInChI=1S/C12H19N/c1-4-10-7-5-6-8-11(10)12(13)9(2)3/h5-9,12H,4,13H2,1-3H3
InChIKeyFYGOLUMGQJWCMY-UHFFFAOYSA-N
XLogP2.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-amino-1-(2-ethylphenyl)propan-2-one
CID 55294273
1-(2-ethylphenyl)-2-propan-2-yloxyethanamine
CID 105013375
2-[(1S)-1-amino-2-methylpropyl]phenol
CID 14939349
ethanol;1-(2-ethylphenyl)ethanol
CID 174807968
1-ethyl-2-[(2S)-pentan-2-yl]benzene
CID 144927407
2-methyl-1-naphthalen-1-ylpropan-1-amine
CID 14948205
(1R)-1-(2-ethylphenyl)-2-methoxyethanamine
CID 146013091
3-amino-3-(2-ethylphenyl)propan-1-ol;hydrochloride
CID 170874839
ethyl 2-(2-ethylphenyl)propanoate
CID 105459112
1-(2,3-diethylphenyl)ethanamine
CID 130066606
N-ethyl-1-(2-ethylphenyl)ethanamine
CID 115781037
(2-ethoxyphenyl)-(2-ethylphenyl)methanamine
CID 115853715

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-2-methylpropan-1-amine?
The IUPAC name of 1-(2-ethylphenyl)-2-methylpropan-1-amine (CID 55283279) is 1-(2-ethylphenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-(2-ethylphenyl)-2-methylpropan-1-amine?
The canonical SMILES for 1-(2-ethylphenyl)-2-methylpropan-1-amine is CCc1ccccc1C(N)C(C)C.
What is the InChIKey of 1-(2-ethylphenyl)-2-methylpropan-1-amine?
The InChIKey is FYGOLUMGQJWCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-4-10-7-5-6-8-11(10)12(13)9(2)3/h5-9,12H,4,13H2,1-3H3.
What are the key properties of 1-(2-ethylphenyl)-2-methylpropan-1-amine?
1-(2-ethylphenyl)-2-methylpropan-1-amine has a molecular weight of 177.29 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 55283279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).