N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine

C15H25N — CID 115854373

IUPACN-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine
SMILESCCNC(c1ccccc1CC)C(C)(C)C
InChIInChI=1S/C15H25N/c1-6-12-10-8-9-11-13(12)14(16-7-2)15(3,4)5/h8-11,14,16H,6-7H2,1-5H3
InChIKeyIDBIIZSRGLTAKG-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.95
Rot. Bonds4

About N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine

N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine (PubChem CID 115854373) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine
PubChem CID115854373
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine
SMILESCCNC(c1ccccc1CC)C(C)(C)C
InChIInChI=1S/C15H25N/c1-6-12-10-8-9-11-13(12)14(16-7-2)15(3,4)5/h8-11,14,16H,6-7H2,1-5H3
InChIKeyIDBIIZSRGLTAKG-UHFFFAOYSA-N
XLogP3.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 62716904
N-ethyl-1-(2-ethylphenyl)ethanamine
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N-ethyl-1-(2-ethylphenyl)prop-2-yn-1-amine
CID 104995728
N-ethylethanamine;1-ethyl-2-[1,2,2-tris(2-ethylphenyl)ethyl]benzene
CID 67736887
N-ethyl-1-(2-ethylphenyl)-5-methylhexan-1-amine
CID 105028868
N-ethyl-1-(2-fluorophenyl)-2-methyl-2-methylsulfonylpropan-1-amine
CID 115827881
1-(2-ethylphenyl)-2-methylpropan-1-amine
CID 55283279
1-(2,4-difluorophenyl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 43491007
N-[(2,3-difluoro-4-methylphenyl)-(2-ethylphenyl)methyl]ethanamine
CID 107515358
1-(2-ethoxyphenyl)-N-ethyl-2-methyl-2-methylsulfonylpropan-1-amine
CID 115853596
1-(2-bromo-4-fluorophenyl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 115854269
1-(2-tert-butylphenyl)-N-ethylethanamine
CID 115765369

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine?
The IUPAC name of N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine (CID 115854373) is N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine is CCNC(c1ccccc1CC)C(C)(C)C.
What is the InChIKey of N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine?
The InChIKey is IDBIIZSRGLTAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-6-12-10-8-9-11-13(12)14(16-7-2)15(3,4)5/h8-11,14,16H,6-7H2,1-5H3.
What are the key properties of N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine?
N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-ethylphenyl)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 115854373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).