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

C14H20FN — CID 64918420

IUPAC1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine
SMILESCCC(NC(C)c1ccccc1F)C1CC1
InChIInChI=1S/C14H20FN/c1-3-14(11-8-9-11)16-10(2)12-6-4-5-7-13(12)15/h4-7,10-11,14,16H,3,8-9H2,1-2H3
InChIKeyRYKVEJPQFPFDQW-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.66
Rot. Bonds5

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

1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine (PubChem CID 64918420) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine
PubChem CID64918420
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine
SMILESCCC(NC(C)c1ccccc1F)C1CC1
InChIInChI=1S/C14H20FN/c1-3-14(11-8-9-11)16-10(2)12-6-4-5-7-13(12)15/h4-7,10-11,14,16H,3,8-9H2,1-2H3
InChIKeyRYKVEJPQFPFDQW-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-N-[1-(3,4-difluorophenyl)ethyl]propan-1-amine
CID 64919026
N-[1-(2-fluorophenyl)ethyl]-2-methylpentan-3-amine
CID 60928177
N-[(1R)-1-(2-fluorophenyl)ethyl]-1-phenylpropan-1-amine
CID 81380238
(1S)-N-[1-(2-fluorophenyl)ethyl]-1-(2-methylphenyl)ethanamine
CID 81375681
N-[cyclopropyl(thiophen-2-yl)methyl]-1-(2-fluorophenyl)ethanamine
CID 54983114
1-(1-cyclopropylethyl)-2-fluorobenzene
CID 126566249
1-cyclopropyl-N-[(1S)-1-(furan-2-yl)ethyl]propan-1-amine
CID 81403177
N-[2-cyclopropyl-2-(2-fluorophenyl)ethyl]-2-methylpropan-1-amine
CID 104819491
2-[[(1R)-1-(2-fluorophenyl)ethyl]amino]butanoic acid
CID 81380426
1-cyclohexyl-N-[1-(2,4-dichloro-5-fluorophenyl)ethyl]propan-1-amine
CID 63479051
N-[(1R)-1-(2-fluorophenyl)ethyl]-1-(oxolan-3-yl)ethanamine
CID 104865494
1-cyclopropyl-N-[(2,6-difluorophenyl)methyl]propan-1-amine
CID 115728904

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine (CID 64918420) is 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine is CCC(NC(C)c1ccccc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine?
The InChIKey is RYKVEJPQFPFDQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-3-14(11-8-9-11)16-10(2)12-6-4-5-7-13(12)15/h4-7,10-11,14,16H,3,8-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine?
1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine has a molecular weight of 221.32 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[1-(2-fluorophenyl)ethyl]propan-1-amine is sourced from PubChem (CID 64918420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).