4-(2-fluoro-2-methylpropyl)piperidin-4-ol

C9H18FNO — CID 90419028

IUPAC4-(2-fluoro-2-methylpropyl)piperidin-4-ol
SMILESCC(C)(F)CC1(O)CCNCC1
InChIInChI=1S/C9H18FNO/c1-8(2,10)7-9(12)3-5-11-6-4-9/h11-12H,3-7H2,1-2H3
InChIKeyQVYZIVWXTUPHOI-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.24
Rot. Bonds2

About 4-(2-fluoro-2-methylpropyl)piperidin-4-ol

4-(2-fluoro-2-methylpropyl)piperidin-4-ol (PubChem CID 90419028) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 4-(2-fluoro-2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(2-fluoro-2-methylpropyl)piperidin-4-ol
PubChem CID90419028
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name4-(2-fluoro-2-methylpropyl)piperidin-4-ol
SMILESCC(C)(F)CC1(O)CCNCC1
InChIInChI=1S/C9H18FNO/c1-8(2,10)7-9(12)3-5-11-6-4-9/h11-12H,3-7H2,1-2H3
InChIKeyQVYZIVWXTUPHOI-UHFFFAOYSA-N
XLogP1.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-2-methylpropyl)piperidin-4-ol?
The IUPAC name of 4-(2-fluoro-2-methylpropyl)piperidin-4-ol (CID 90419028) is 4-(2-fluoro-2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for 4-(2-fluoro-2-methylpropyl)piperidin-4-ol?
The canonical SMILES for 4-(2-fluoro-2-methylpropyl)piperidin-4-ol is CC(C)(F)CC1(O)CCNCC1.
What is the InChIKey of 4-(2-fluoro-2-methylpropyl)piperidin-4-ol?
The InChIKey is QVYZIVWXTUPHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-8(2,10)7-9(12)3-5-11-6-4-9/h11-12H,3-7H2,1-2H3.
What are the key properties of 4-(2-fluoro-2-methylpropyl)piperidin-4-ol?
4-(2-fluoro-2-methylpropyl)piperidin-4-ol has a molecular weight of 175.25 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 90419028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).