N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine

C19H24FN — CID 62367606

IUPACN-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine
SMILESCCNC(CCc1ccccc1C)Cc1cccc(F)c1
InChIInChI=1S/C19H24FN/c1-3-21-19(14-16-8-6-10-18(20)13-16)12-11-17-9-5-4-7-15(17)2/h4-10,13,19,21H,3,11-12,14H2,1-2H3
InChIKeyPYIQLVCYOWFILF-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.29
Rot. Bonds7

About N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine

N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine (PubChem CID 62367606) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine
PubChem CID62367606
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC NameN-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine
SMILESCCNC(CCc1ccccc1C)Cc1cccc(F)c1
InChIInChI=1S/C19H24FN/c1-3-21-19(14-16-8-6-10-18(20)13-16)12-11-17-9-5-4-7-15(17)2/h4-10,13,19,21H,3,11-12,14H2,1-2H3
InChIKeyPYIQLVCYOWFILF-UHFFFAOYSA-N
XLogP4.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
CID 61065597
1-[3-chloro-4-(3-fluorophenyl)butyl]-2-methylbenzene
CID 63542842
1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-ol
CID 55149163
[1-(3-fluorophenyl)-3-(2-methylphenyl)propan-2-yl]hydrazine
CID 105204751
N-ethyl-1-(3-fluorophenyl)-6-methylheptan-2-amine
CID 83161562
2-N-ethyl-3-(3-fluorophenyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 79093303
N-ethyl-1-(3-fluorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103009449
1-(3-chlorophenyl)-N-ethyl-3-(3-fluorophenyl)propan-2-amine
CID 60819525
N-ethyl-4-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)butan-2-amine
CID 105114186
N-ethyl-1-(3-fluorophenyl)-3-(furan-3-yl)propan-2-amine
CID 83175905
N-ethyl-1-(2-methylphenyl)heptan-3-amine
CID 105125674
N,5-diethyl-1-(2-methylphenyl)heptan-3-amine
CID 105176885

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine?
The IUPAC name of N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine (CID 62367606) is N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine.
What is the SMILES notation for N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine?
The canonical SMILES for N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine is CCNC(CCc1ccccc1C)Cc1cccc(F)c1.
What is the InChIKey of N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine?
The InChIKey is PYIQLVCYOWFILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-3-21-19(14-16-8-6-10-18(20)13-16)12-11-17-9-5-4-7-15(17)2/h4-10,13,19,21H,3,11-12,14H2,1-2H3.
What are the key properties of N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine?
N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine has a molecular weight of 285.41 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine is sourced from PubChem (CID 62367606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).