[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol

C12H17FN2O — CID 60790060

IUPAC[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol
SMILESNc1c(F)cccc1N1CCC(CO)CC1
InChIInChI=1S/C12H17FN2O/c13-10-2-1-3-11(12(10)14)15-6-4-9(8-16)5-7-15/h1-3,9,16H,4-8,14H2
InChIKeyUAODYZYKZVXSDF-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.62
Rot. Bonds2

About [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol

[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol (PubChem CID 60790060) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol
PubChem CID60790060
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol
SMILESNc1c(F)cccc1N1CCC(CO)CC1
InChIInChI=1S/C12H17FN2O/c13-10-2-1-3-11(12(10)14)15-6-4-9(8-16)5-7-15/h1-3,9,16H,4-8,14H2
InChIKeyUAODYZYKZVXSDF-UHFFFAOYSA-N
XLogP1.62
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[1-(2-amino-3-fluorophenyl)piperidin-4-yl]oxyethanol
CID 82695538
[1-(4-amino-2-fluorophenyl)piperidin-4-yl]methanol
CID 43133145
2-[4-(hydroxymethyl)piperidin-1-yl]phenol
CID 71530927
1-(2-amino-3-fluorophenyl)-N-methylpiperidine-4-carboxamide
CID 60789324
[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol
CID 155172642
1-(2-amino-3-fluorophenyl)-N,N-diethylpyrrolidin-3-amine
CID 63168224
[1-(2-ethylphenyl)piperidin-4-yl]methanol
CID 117027933
[1-[2-fluoro-4-(hydroxymethyl)phenyl]piperidin-4-yl]methanol
CID 43133225
(2-amino-3-fluorophenyl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 112625110
1-[2-fluoro-6-[3-(hydroxymethyl)pyrrolidin-1-yl]phenyl]ethanone
CID 112692568
3-fluoro-4-[4-(hydroxymethyl)piperidin-1-yl]benzenecarboximidamide;hydrochloride
CID 82253493
1-(2,3-difluorophenyl)-4-ethylpiperidine
CID 155298255

Frequently Asked Questions

What is the IUPAC name of [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol (CID 60790060) is [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol is Nc1c(F)cccc1N1CCC(CO)CC1.
What is the InChIKey of [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol?
The InChIKey is UAODYZYKZVXSDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c13-10-2-1-3-11(12(10)14)15-6-4-9(8-16)5-7-15/h1-3,9,16H,4-8,14H2.
What are the key properties of [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol?
[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol has a molecular weight of 224.28 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 60790060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).