2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine

C12H16FN — CID 83830466

IUPAC2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine
SMILESCC(CN)(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C12H16FN/c1-12(8-14,9-2-3-9)10-4-6-11(13)7-5-10/h4-7,9H,2-3,8,14H2,1H3
InChIKeyJSRCATKNCAUZAG-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.45
Rot. Bonds3

About 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine

2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine (PubChem CID 83830466) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine
PubChem CID83830466
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine
SMILESCC(CN)(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C12H16FN/c1-12(8-14,9-2-3-9)10-4-6-11(13)7-5-10/h4-7,9H,2-3,8,14H2,1H3
InChIKeyJSRCATKNCAUZAG-UHFFFAOYSA-N
XLogP2.45
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 ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopropyl-2-fluoro-2-(4-fluorophenyl)ethanamine
CID 112567178
2-(1,3-benzodioxol-5-yl)-2-cyclopropylpropan-1-amine
CID 83837134
2-(1-benzofuran-5-yl)-2-cyclopropylpropan-1-amine
CID 83835621
2-(4-fluorophenyl)propane-1,2-diamine
CID 116855534
3,3-difluoro-2-(4-fluorophenyl)-2-methylpropan-1-amine
CID 84721556
1-fluoro-4-[2-(4-fluorophenyl)propan-2-yl]benzene
CID 22572271
1-cyclohexyl-2-(4-fluorophenyl)propan-2-amine
CID 62621993
3-cyclobutyl-2-N-(4-fluorophenyl)-2-N,2-dimethylpropane-1,2-diamine
CID 113490010
2-cyclopropyl-2-(furan-2-yl)propan-1-amine
CID 83826821
[1-cyclobutyl-3-(4-fluorophenyl)-3-methylbutan-2-yl]hydrazine
CID 105223629
[1-cycloheptyl-2-(4-fluorophenyl)-2-methylpropyl]hydrazine
CID 105223583
3-amino-2-cyclobutyl-2-(4-fluorophenyl)propanoic acid
CID 106490917

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine (CID 83830466) is 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine is CC(CN)(c1ccc(F)cc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine?
The InChIKey is JSRCATKNCAUZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-12(8-14,9-2-3-9)10-4-6-11(13)7-5-10/h4-7,9H,2-3,8,14H2,1H3.
What are the key properties of 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine?
2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine has a molecular weight of 193.27 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(4-fluorophenyl)propan-1-amine is sourced from PubChem (CID 83830466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).