N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine

C15H24FN — CID 105374122

IUPACN-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine
SMILESCCCCC(Cc1cc(F)ccc1C)NCC
InChIInChI=1S/C15H24FN/c1-4-6-7-15(17-5-2)11-13-10-14(16)9-8-12(13)3/h8-10,15,17H,4-7,11H2,1-3H3
InChIKeyKXHIYZUICBUEPJ-UHFFFAOYSA-N
MW237.36 g/mol
LogP3.84
Rot. Bonds7

About N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine

N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine (PubChem CID 105374122) has the molecular formula C15H24FN and a molecular weight of 237.36 g/mol. Its IUPAC name is N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine
PubChem CID105374122
Molecular FormulaC15H24FN
Molecular Weight237.36 g/mol
Exact Mass237.19
IUPAC NameN-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine
SMILESCCCCC(Cc1cc(F)ccc1C)NCC
InChIInChI=1S/C15H24FN/c1-4-6-7-15(17-5-2)11-13-10-14(16)9-8-12(13)3/h8-10,15,17H,4-7,11H2,1-3H3
InChIKeyKXHIYZUICBUEPJ-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-fluoro-2-methylphenyl)-N-propylheptan-2-amine
CID 105377481
1-(5-fluoro-2-methylphenyl)-N-methyldecan-2-amine
CID 105377260
1-(3,4-dimethylphenyl)-N-ethylhexan-2-amine
CID 62538478
1-(5-fluoro-2-methylphenyl)-N-propylbutan-2-amine
CID 105373717
N-ethyl-1-(2-methylphenyl)decan-2-amine
CID 63417244
1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
CID 61482090
1-(3-chlorophenyl)-N-ethyl-3-(5-fluoro-2-methylphenyl)propan-2-amine
CID 105373667
1-(5-fluoro-2-methylphenyl)undecan-2-amine
CID 105377088
1-(5-fluoro-2-methylphenyl)nonan-2-amine
CID 105377125
3-(5-fluoro-2-methylphenyl)-1-N,1-N-dimethyl-2-N-propylpropane-1,2-diamine
CID 105374110
N-ethyl-4-(5-fluoro-2-methylphenyl)-1-methoxybutan-2-amine
CID 105372347
1-(5-fluoro-2-methylphenyl)-N-propylheptan-4-amine
CID 105375522

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine?
The IUPAC name of N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine (CID 105374122) is N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine.
What is the SMILES notation for N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine?
The canonical SMILES for N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine is CCCCC(Cc1cc(F)ccc1C)NCC.
What is the InChIKey of N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine?
The InChIKey is KXHIYZUICBUEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN/c1-4-6-7-15(17-5-2)11-13-10-14(16)9-8-12(13)3/h8-10,15,17H,4-7,11H2,1-3H3.
What are the key properties of N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine?
N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine has a molecular weight of 237.36 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-fluoro-2-methylphenyl)hexan-2-amine is sourced from PubChem (CID 105374122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).