1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol

C12H16FNO — CID 62397151

IUPAC1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol
SMILESCC1CC1NCC(O)c1ccc(F)cc1
InChIInChI=1S/C12H16FNO/c1-8-6-11(8)14-7-12(15)9-2-4-10(13)5-3-9/h2-5,8,11-12,14-15H,6-7H2,1H3
InChIKeyZCKDHOZUNQSDTH-UHFFFAOYSA-N
MW209.26 g/mol
LogP1.86
Rot. Bonds4

About 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol

1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol (PubChem CID 62397151) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol
PubChem CID62397151
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol
SMILESCC1CC1NCC(O)c1ccc(F)cc1
InChIInChI=1S/C12H16FNO/c1-8-6-11(8)14-7-12(15)9-2-4-10(13)5-3-9/h2-5,8,11-12,14-15H,6-7H2,1H3
InChIKeyZCKDHOZUNQSDTH-UHFFFAOYSA-N
XLogP1.86
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-cyclopropyloxolan-3-yl)amino]-1-(4-fluorophenyl)ethanol
CID 103580825
1-(4-fluorophenyl)-2-[(3-methylcyclopentyl)methylamino]ethanol
CID 107412879
1-(3-methoxyphenyl)-2-[(2-methylcyclopropyl)amino]ethanol
CID 81133622
(1S)-1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanol
CID 42553259
(1S)-1-phenyl-2-[[(2R,4R,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 124739387
1-(4-fluorophenyl)-2-[(1-oxothian-4-yl)amino]ethanol
CID 113479901
1-(4-fluorophenyl)-2-(2-methylpropylamino)ethanol
CID 54594094
N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine
CID 62397881
4-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]pyrrolidin-2-one
CID 106189351
2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol
CID 43635434
2-(4-fluoroanilino)-1-(4-fluorophenyl)ethanol
CID 60719916
4-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]cyclohexane-1-carboxamide
CID 61043138

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol (CID 62397151) is 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol is CC1CC1NCC(O)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol?
The InChIKey is ZCKDHOZUNQSDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-8-6-11(8)14-7-12(15)9-2-4-10(13)5-3-9/h2-5,8,11-12,14-15H,6-7H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol?
1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol has a molecular weight of 209.26 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol is sourced from PubChem (CID 62397151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).