[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol

C14H20FNO2 — CID 123312562

IUPAC[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol
SMILESCc1cccc(F)c1CCC1CNC(CO)CO1
InChIInChI=1S/C14H20FNO2/c1-10-3-2-4-14(15)13(10)6-5-12-7-16-11(8-17)9-18-12/h2-4,11-12,16-17H,5-9H2,1H3
InChIKeyABYZBXIXHPFWQT-UHFFFAOYSA-N
MW253.32 g/mol
LogP1.42
Rot. Bonds4

About [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol

[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol (PubChem CID 123312562) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol
PubChem CID123312562
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol
SMILESCc1cccc(F)c1CCC1CNC(CO)CO1
InChIInChI=1S/C14H20FNO2/c1-10-3-2-4-14(15)13(10)6-5-12-7-16-11(8-17)9-18-12/h2-4,11-12,16-17H,5-9H2,1H3
InChIKeyABYZBXIXHPFWQT-UHFFFAOYSA-N
XLogP1.42
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol?
The IUPAC name of [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol (CID 123312562) is [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol.
What is the SMILES notation for [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol?
The canonical SMILES for [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol is Cc1cccc(F)c1CCC1CNC(CO)CO1.
What is the InChIKey of [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol?
The InChIKey is ABYZBXIXHPFWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-10-3-2-4-14(15)13(10)6-5-12-7-16-11(8-17)9-18-12/h2-4,11-12,16-17H,5-9H2,1H3.
What are the key properties of [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol?
[6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol has a molecular weight of 253.32 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-(2-fluoro-6-methylphenyl)ethyl]morpholin-3-yl]methanol is sourced from PubChem (CID 123312562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).