2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol

C14H20FNO — CID 110008170

IUPAC2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol
SMILESOCCN(CCCc1cccc(F)c1)C1CC1
InChIInChI=1S/C14H20FNO/c15-13-5-1-3-12(11-13)4-2-8-16(9-10-17)14-6-7-14/h1,3,5,11,14,17H,2,4,6-10H2
InChIKeyJOSAEOSFDGGPOP-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.21
Rot. Bonds7

About 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol

2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol (PubChem CID 110008170) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol
PubChem CID110008170
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol
SMILESOCCN(CCCc1cccc(F)c1)C1CC1
InChIInChI=1S/C14H20FNO/c15-13-5-1-3-12(11-13)4-2-8-16(9-10-17)14-6-7-14/h1,3,5,11,14,17H,2,4,6-10H2
InChIKeyJOSAEOSFDGGPOP-UHFFFAOYSA-N
XLogP2.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[ethyl-[3-(3-fluorophenyl)propyl]amino]ethanol
CID 110008924
N'-cyclopropyl-N'-[(3-fluorophenyl)methyl]propane-1,3-diamine
CID 43137498
[4-[[cyclopropyl-[(3-fluorophenyl)methyl]amino]methyl]phenyl]methanol
CID 110008215
3-[cyclopentyl(2-hydroxyethyl)amino]-1-(3-fluorophenyl)propan-1-one
CID 62619727
3-[2-(3-fluorophenyl)ethyl-methylamino]propan-1-ol
CID 115217213
2-[[3-(3-fluorophenyl)propyl-methylamino]methyl]cyclopentan-1-ol
CID 110009639
3-[cyclopropyl(2-hydroxyethyl)amino]propan-1-ol
CID 61067850
2-[cyclobutyl-[(3,5-difluorophenyl)methyl]amino]ethanol
CID 102676798
1-(3-cyclopentylpropyl)-3-fluorobenzene
CID 118922459
4-[2-(3-fluorophenyl)ethyl-methylamino]butan-1-ol
CID 115217920
3-[cyclopropyl(3-phenylpropyl)amino]propanoic acid
CID 60838690
3-[3-[cyclopropyl(2-methoxyethyl)amino]propyl]aniline
CID 113290639

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol (CID 110008170) is 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol is OCCN(CCCc1cccc(F)c1)C1CC1.
What is the InChIKey of 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol?
The InChIKey is JOSAEOSFDGGPOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c15-13-5-1-3-12(11-13)4-2-8-16(9-10-17)14-6-7-14/h1,3,5,11,14,17H,2,4,6-10H2.
What are the key properties of 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol?
2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol has a molecular weight of 237.32 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[3-(3-fluorophenyl)propyl]amino]ethanol is sourced from PubChem (CID 110008170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).