1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine

C19H24FN — CID 63417000

IUPAC1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cccc(C)c1)Cc1cccc(F)c1
InChIInChI=1S/C19H24FN/c1-3-10-21-19(13-16-7-4-6-15(2)11-16)14-17-8-5-9-18(20)12-17/h4-9,11-12,19,21H,3,10,13-14H2,1-2H3
InChIKeySVTVVZNSTLLQED-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.29
Rot. Bonds7

About 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine

1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine (PubChem CID 63417000) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine
PubChem CID63417000
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cccc(C)c1)Cc1cccc(F)c1
InChIInChI=1S/C19H24FN/c1-3-10-21-19(13-16-7-4-6-15(2)11-16)14-17-8-5-9-18(20)12-17/h4-9,11-12,19,21H,3,10,13-14H2,1-2H3
InChIKeySVTVVZNSTLLQED-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

1-(3-fluorophenyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 62552908
1-(furan-3-yl)-3-(3-methylphenyl)-N-propylpropan-2-amine
CID 83175808
1-(3-methylphenyl)-N-propylpent-4-yn-2-amine
CID 62235336
1-(5-bromo-3-pyridinyl)-3-(3-fluorophenyl)-N-propylpropan-2-amine
CID 104801501
6,6,6-trifluoro-1-(3-methylphenyl)-N-propylhexan-2-amine
CID 115516541
1-(3-fluorophenyl)-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642847
1-(5-bromo-2-pyridinyl)-3-(3-fluorophenyl)-N-propylpropan-2-amine
CID 104801503
N-[1-(2,6-difluorophenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 63526394
4-(3-methylphenyl)-1-phenyl-N-propylbutan-2-amine
CID 63528116
1-cycloheptyl-3-(3-methylphenyl)-N-propylpropan-2-amine
CID 114458153
N-[1-(2-fluoro-5-methylphenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 63415224
N-[2-(3-fluorophenyl)-1-(2-methylcyclopropyl)ethyl]propan-1-amine
CID 61064174

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine?
The IUPAC name of 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine (CID 63417000) is 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine?
The canonical SMILES for 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine is CCCNC(Cc1cccc(C)c1)Cc1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine?
The InChIKey is SVTVVZNSTLLQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-3-10-21-19(13-16-7-4-6-15(2)11-16)14-17-8-5-9-18(20)12-17/h4-9,11-12,19,21H,3,10,13-14H2,1-2H3.
What are the key properties of 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine?
1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-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 1-(3-fluorophenyl)-3-(3-methylphenyl)-N-propylpropan-2-amine is sourced from PubChem (CID 63417000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).