2-(3-fluorophenyl)-1-propylcyclopropan-1-amine

C12H16FN — CID 84665026

IUPAC2-(3-fluorophenyl)-1-propylcyclopropan-1-amine
SMILESCCCC1(N)CC1c1cccc(F)c1
InChIInChI=1S/C12H16FN/c1-2-6-12(14)8-11(12)9-4-3-5-10(13)7-9/h3-5,7,11H,2,6,8,14H2,1H3
InChIKeyVJGPIDHTTCWIHL-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.81
Rot. Bonds3

About 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine

2-(3-fluorophenyl)-1-propylcyclopropan-1-amine (PubChem CID 84665026) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-propylcyclopropan-1-amine
PubChem CID84665026
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name2-(3-fluorophenyl)-1-propylcyclopropan-1-amine
SMILESCCCC1(N)CC1c1cccc(F)c1
InChIInChI=1S/C12H16FN/c1-2-6-12(14)8-11(12)9-4-3-5-10(13)7-9/h3-5,7,11H,2,6,8,14H2,1H3
InChIKeyVJGPIDHTTCWIHL-UHFFFAOYSA-N
XLogP2.81
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-2-(3-methylphenyl)cyclopropan-1-amine
CID 84655385
1-amino-2-(3-fluorophenyl)cyclopropane-1-carboxylic acid
CID 53276276
1-cyclobutyl-2-(3-fluorophenyl)cyclopropan-1-amine
CID 84673435
1-ethyl-2-(3-methoxyphenyl)cyclopropan-1-amine;hydrochloride
CID 90198014
cis-(1S,2R)-2-(4-bromo-3-fluorophenyl)-1-ethylcyclopropan-1-amine
CID 118732679
[(1R,2R)-2-(3-fluorophenyl)cyclopropyl]methanamine;hydrochloride
CID 68924561
2-(3-fluorophenyl)-5-propyl-1,3-dioxane
CID 54244668
3-(3-fluorophenyl)azetidine;heptane;hydrochloride
CID 175294675
1-chloro-2-(3-fluorophenyl)cyclopropane-1-carboxylic acid
CID 152624369
2-(3-azidophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
CID 90197472
1-[4-[3-(4-butylcyclohexyl)propyl]cyclohexyl]-3-fluorobenzene
CID 139725252
(3R,4R)-3-(3-fluorophenyl)-4-propylpyrrolidine
CID 125452265

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine?
The IUPAC name of 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine (CID 84665026) is 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine.
What is the SMILES notation for 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine?
The canonical SMILES for 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine is CCCC1(N)CC1c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine?
The InChIKey is VJGPIDHTTCWIHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-2-6-12(14)8-11(12)9-4-3-5-10(13)7-9/h3-5,7,11H,2,6,8,14H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine?
2-(3-fluorophenyl)-1-propylcyclopropan-1-amine has a molecular weight of 193.27 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-propylcyclopropan-1-amine is sourced from PubChem (CID 84665026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).