1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine

C15H25N — CID 61482090

IUPAC1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
SMILESCCCC(Cc1cc(C)ccc1C)NCC
InChIInChI=1S/C15H25N/c1-5-7-15(16-6-2)11-14-10-12(3)8-9-13(14)4/h8-10,15-16H,5-7,11H2,1-4H3
InChIKeyBDKONYGSNJRWTG-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.62
Rot. Bonds6

About 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine

1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine (PubChem CID 61482090) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
PubChem CID61482090
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
SMILESCCCC(Cc1cc(C)ccc1C)NCC
InChIInChI=1S/C15H25N/c1-5-7-15(16-6-2)11-14-10-12(3)8-9-13(14)4/h8-10,15-16H,5-7,11H2,1-4H3
InChIKeyBDKONYGSNJRWTG-UHFFFAOYSA-N
XLogP3.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-N-ethyl-5-methoxypentan-2-amine
CID 65092524
1-(2,5-dimethylphenyl)-N-ethyl-3-propylhexan-2-amine
CID 82987222
1-(2,5-dimethylphenyl)-N-ethyl-4-pyridin-4-ylbutan-2-amine
CID 105101158
1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine
CID 61482245
1-(2,5-dimethylphenyl)-N-ethyl-4-thiophen-3-ylbutan-2-amine
CID 115856849
1-(2,5-dimethylphenyl)-4-methyl-N-propylheptan-2-amine
CID 115845513
N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine
CID 105374122
1-(2,5-dimethylphenyl)-N-ethyl-5-(oxolan-2-yl)pentan-2-amine
CID 104993079
1-(2,5-dimethylphenyl)-5-methylsulfonyl-N-propylpentan-2-amine
CID 115820693
1-(2,5-dimethylphenyl)-N-ethyl-3-(1-methoxycyclobutyl)propan-2-amine
CID 103556957
1-(5-bromo-2-pyridinyl)-3-(2,5-dimethylphenyl)-N-ethylpropan-2-amine
CID 105036122
1-(2,5-dimethylphenyl)-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 115860977

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine (CID 61482090) is 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine is CCCC(Cc1cc(C)ccc1C)NCC.
What is the InChIKey of 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
The InChIKey is BDKONYGSNJRWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-5-7-15(16-6-2)11-14-10-12(3)8-9-13(14)4/h8-10,15-16H,5-7,11H2,1-4H3.
What are the key properties of 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine?
1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine has a molecular weight of 219.37 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine is sourced from PubChem (CID 61482090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).