[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol

C10H20FNO — CID 115017921

IUPAC[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol
SMILESCC(F)CC1CCN(C)CC1CO
InChIInChI=1S/C10H20FNO/c1-8(11)5-9-3-4-12(2)6-10(9)7-13/h8-10,13H,3-7H2,1-2H3
InChIKeyBOBNSVKWWPMUJC-UHFFFAOYSA-N
MW189.27 g/mol
LogP1.29
Rot. Bonds3

About [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol

[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol (PubChem CID 115017921) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol.

Molecular Properties

Compound Name[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol
PubChem CID115017921
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol
SMILESCC(F)CC1CCN(C)CC1CO
InChIInChI=1S/C10H20FNO/c1-8(11)5-9-3-4-12(2)6-10(9)7-13/h8-10,13H,3-7H2,1-2H3
InChIKeyBOBNSVKWWPMUJC-UHFFFAOYSA-N
XLogP1.29
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol?
The IUPAC name of [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol (CID 115017921) is [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol.
What is the SMILES notation for [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol?
The canonical SMILES for [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol is CC(F)CC1CCN(C)CC1CO.
What is the InChIKey of [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol?
The InChIKey is BOBNSVKWWPMUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO/c1-8(11)5-9-3-4-12(2)6-10(9)7-13/h8-10,13H,3-7H2,1-2H3.
What are the key properties of [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol?
[4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol has a molecular weight of 189.27 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluoropropyl)-1-methylpiperidin-3-yl]methanol is sourced from PubChem (CID 115017921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).