[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol

C9H18FNO2 — CID 81219071

IUPAC[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1CCCF
InChIInChI=1S/C9H18FNO2/c1-8-7-13-9(6-12)5-11(8)4-2-3-10/h8-9,12H,2-7H2,1H3
InChIKeyPIPOHLXAYTXHAC-UHFFFAOYSA-N
MW191.25 g/mol
LogP0.43
Rot. Bonds4

About [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol

[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol (PubChem CID 81219071) has the molecular formula C9H18FNO2 and a molecular weight of 191.25 g/mol. Its IUPAC name is [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol
PubChem CID81219071
Molecular FormulaC9H18FNO2
Molecular Weight191.25 g/mol
Exact Mass191.13
IUPAC Name[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1CCCF
InChIInChI=1S/C9H18FNO2/c1-8-7-13-9(6-12)5-11(8)4-2-3-10/h8-9,12H,2-7H2,1H3
InChIKeyPIPOHLXAYTXHAC-UHFFFAOYSA-N
XLogP0.43
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol (CID 81219071) is [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol is CC1COC(CO)CN1CCCF.
What is the InChIKey of [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol?
The InChIKey is PIPOHLXAYTXHAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO2/c1-8-7-13-9(6-12)5-11(8)4-2-3-10/h8-9,12H,2-7H2,1H3.
What are the key properties of [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol?
[4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol has a molecular weight of 191.25 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-fluoropropyl)-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 81219071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).