1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol

C18H27FN2O2 — CID 110900534

IUPAC1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol
SMILESCC1CN(C2CCN(CC(O)c3ccccc3F)CC2)CCO1
InChIInChI=1S/C18H27FN2O2/c1-14-12-21(10-11-23-14)15-6-8-20(9-7-15)13-18(22)16-4-2-3-5-17(16)19/h2-5,14-15,18,22H,6-13H2,1H3
InChIKeyNNCCSSHGIPUEBW-UHFFFAOYSA-N
MW322.42 g/mol
LogP2.04
Rot. Bonds4

About 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol

1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol (PubChem CID 110900534) has the molecular formula C18H27FN2O2 and a molecular weight of 322.42 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol
PubChem CID110900534
Molecular FormulaC18H27FN2O2
Molecular Weight322.42 g/mol
Exact Mass322.21
IUPAC Name1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol
SMILESCC1CN(C2CCN(CC(O)c3ccccc3F)CC2)CCO1
InChIInChI=1S/C18H27FN2O2/c1-14-12-21(10-11-23-14)15-6-8-20(9-7-15)13-18(22)16-4-2-3-5-17(16)19/h2-5,14-15,18,22H,6-13H2,1H3
InChIKeyNNCCSSHGIPUEBW-UHFFFAOYSA-N
XLogP2.04
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aziridin-1-yl)-1-(2-fluorophenyl)ethanol
CID 82125307
(1S)-1-(2-fluorophenyl)-2-[4-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]ethanol
CID 34179618
1-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]-3-(2-methylphenoxy)propan-2-ol
CID 110900539
1-(2-fluorophenyl)-2-(3-pyrrolidin-1-ylpiperidin-1-yl)ethanol
CID 110898564
2-[4-(cyclopropylmethyl)piperazin-1-yl]-1-(2-fluorophenyl)ethanol
CID 103619777
(2S)-1-[(2R)-4-[(2R)-2-(2-fluorophenyl)-2-hydroxyethyl]-2-methylpiperazin-1-yl]propan-2-ol
CID 124778972
1-(2-fluorophenyl)-2-(3-propylpyrrolidin-1-yl)ethanol
CID 113246642
2-methyl-4-[1-(2-phenylsulfanylethyl)piperidin-4-yl]morpholine
CID 56792229
(1R)-2-[4-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]-1-phenylethanol
CID 95319125
2-(2-methyl-1,4-oxazepan-4-yl)-1-(2-methylphenyl)ethanol
CID 62973662
2-(4-ethyl-1,4-diazepan-1-yl)-1-(2-fluorophenyl)ethanol
CID 111102980
2-[4-(cyclohexylmethyl)piperazin-1-yl]-1-(2-fluorophenyl)ethanol
CID 110908424

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol?
The IUPAC name of 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol (CID 110900534) is 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol?
The canonical SMILES for 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol is CC1CN(C2CCN(CC(O)c3ccccc3F)CC2)CCO1.
What is the InChIKey of 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol?
The InChIKey is NNCCSSHGIPUEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27FN2O2/c1-14-12-21(10-11-23-14)15-6-8-20(9-7-15)13-18(22)16-4-2-3-5-17(16)19/h2-5,14-15,18,22H,6-13H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol?
1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol has a molecular weight of 322.42 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]ethanol is sourced from PubChem (CID 110900534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).