2-(3-ethylphenyl)-N,N-dimethylethanamine

C12H19N — CID 68500116

IUPAC2-(3-ethylphenyl)-N,N-dimethylethanamine
SMILESCCc1cccc(CCN(C)C)c1
InChIInChI=1S/C12H19N/c1-4-11-6-5-7-12(10-11)8-9-13(2)3/h5-7,10H,4,8-9H2,1-3H3
InChIKeyGFYDXFXSAZPGIL-UHFFFAOYSA-N
MW177.29 g/mol
LogP2.35
Rot. Bonds4

About 2-(3-ethylphenyl)-N,N-dimethylethanamine

2-(3-ethylphenyl)-N,N-dimethylethanamine (PubChem CID 68500116) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 2-(3-ethylphenyl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(3-ethylphenyl)-N,N-dimethylethanamine
PubChem CID68500116
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name2-(3-ethylphenyl)-N,N-dimethylethanamine
SMILESCCc1cccc(CCN(C)C)c1
InChIInChI=1S/C12H19N/c1-4-11-6-5-7-12(10-11)8-9-13(2)3/h5-7,10H,4,8-9H2,1-3H3
InChIKeyGFYDXFXSAZPGIL-UHFFFAOYSA-N
XLogP2.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N'-[(3-ethylphenyl)methyl]-N,N-dimethyl-N'-(2-phenylethyl)ethane-1,2-diamine
CID 70827105
3-[2-(dimethylamino)ethyl]aniline
CID 28720801
N-[(3-ethylphenyl)methyl]-N',N'-dimethylethane-1,2-diamine
CID 70966338
N,N-dimethyl-2-(3-nitrosophenyl)ethanamine
CID 143527748
1-ethyl-3-(2-phenylethyl)benzene;molecular hydrogen
CID 142077285
N'-benzyl-N'-[(3-ethylphenyl)methyl]-N,N-dimethylethane-1,2-diamine;butane;ethane
CID 143170387
ethane;N'-(3-ethylphenyl)-N,N-dimethyl-N'-(2-phenylethyl)propane-1,3-diamine
CID 143170107
N,N-dimethyl-2-phenylethanamine;hydrazine
CID 159470324
(E)-but-2-ene;ethane;N-[(3-ethylphenyl)methyl]-N',N'-dimethylethane-1,2-diamine
CID 143170155
3-(dimethylamino)-1-(3-ethylphenyl)propan-1-ol
CID 115346033
ethane;1-ethyl-3-(3-methylbutyl)benzene
CID 143683822
N'-[(2,6-dichlorophenyl)methyl]-N'-[(3-ethylphenyl)methyl]-N,N-dimethylethane-1,2-diamine
CID 70827284

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenyl)-N,N-dimethylethanamine?
The IUPAC name of 2-(3-ethylphenyl)-N,N-dimethylethanamine (CID 68500116) is 2-(3-ethylphenyl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(3-ethylphenyl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(3-ethylphenyl)-N,N-dimethylethanamine is CCc1cccc(CCN(C)C)c1.
What is the InChIKey of 2-(3-ethylphenyl)-N,N-dimethylethanamine?
The InChIKey is GFYDXFXSAZPGIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-4-11-6-5-7-12(10-11)8-9-13(2)3/h5-7,10H,4,8-9H2,1-3H3.
What are the key properties of 2-(3-ethylphenyl)-N,N-dimethylethanamine?
2-(3-ethylphenyl)-N,N-dimethylethanamine has a molecular weight of 177.29 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenyl)-N,N-dimethylethanamine is sourced from PubChem (CID 68500116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).