N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine

C19H24FN — CID 114828627

IUPACN-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine
SMILESCCc1ccc(C(C)NC(C)Cc2ccccc2F)cc1
InChIInChI=1S/C19H24FN/c1-4-16-9-11-17(12-10-16)15(3)21-14(2)13-18-7-5-6-8-19(18)20/h5-12,14-15,21H,4,13H2,1-3H3
InChIKeyPEAWKONJDSVWKJ-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.67
Rot. Bonds6

About N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine

N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine (PubChem CID 114828627) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine
PubChem CID114828627
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine
SMILESCCc1ccc(C(C)NC(C)Cc2ccccc2F)cc1
InChIInChI=1S/C19H24FN/c1-4-16-9-11-17(12-10-16)15(3)21-14(2)13-18-7-5-6-8-19(18)20/h5-12,14-15,21H,4,13H2,1-3H3
InChIKeyPEAWKONJDSVWKJ-UHFFFAOYSA-N
XLogP4.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-2-amine
CID 114828278
N-[1-(2,5-difluorophenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine
CID 114828542
N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)methanesulfonamide
CID 127508935
1-(2-fluorophenyl)-N-(1-methylsulfanylpropan-2-yl)propan-2-amine
CID 114830832
3-[1-(2-fluorophenyl)propan-2-ylamino]pentanenitrile
CID 114829727
N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]acetamide
CID 31542494
3-[1-(2-fluorophenyl)propan-2-ylamino]butan-1-ol
CID 115976612
N-[1-(4-ethylphenyl)ethyl]-1-methoxypropan-2-amine
CID 43191926
1-(2-fluorophenyl)-N-[1-(1,3-thiazol-2-yl)ethyl]propan-2-amine
CID 113348121
N-[1-(2-fluorophenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 60943739
N-[1-(4-iodophenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 63449736
1-(3-fluorophenyl)-N-[(1S)-1-(4-fluorophenyl)ethyl]propan-2-amine
CID 104979722

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine (CID 114828627) is N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine is CCc1ccc(C(C)NC(C)Cc2ccccc2F)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine?
The InChIKey is PEAWKONJDSVWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-4-16-9-11-17(12-10-16)15(3)21-14(2)13-18-7-5-6-8-19(18)20/h5-12,14-15,21H,4,13H2,1-3H3.
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine?
N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine has a molecular weight of 285.41 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)propan-2-amine is sourced from PubChem (CID 114828627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).