[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride

C7H14ClF2NO — CID 155859027

IUPAC[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride
SMILESCl.OCC1(C(F)F)CCNCC1
InChIInChI=1S/C7H13F2NO.ClH/c8-6(9)7(5-11)1-3-10-4-2-7;/h6,10-11H,1-5H2;1H
InChIKeyADMZLAUCVRTXIN-UHFFFAOYSA-N
MW201.64 g/mol
LogP1.04
Rot. Bonds2

About [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride

[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride (PubChem CID 155859027) has the molecular formula C7H14ClF2NO and a molecular weight of 201.64 g/mol. Its IUPAC name is [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride
PubChem CID155859027
Molecular FormulaC7H14ClF2NO
Molecular Weight201.64 g/mol
Exact Mass201.07
IUPAC Name[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride
SMILESCl.OCC1(C(F)F)CCNCC1
InChIInChI=1S/C7H13F2NO.ClH/c8-6(9)7(5-11)1-3-10-4-2-7;/h6,10-11H,1-5H2;1H
InChIKeyADMZLAUCVRTXIN-UHFFFAOYSA-N
XLogP1.04
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.64
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride?
The IUPAC name of [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride (CID 155859027) is [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride.
What is the SMILES notation for [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride?
The canonical SMILES for [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride is Cl.OCC1(C(F)F)CCNCC1.
What is the InChIKey of [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride?
The InChIKey is ADMZLAUCVRTXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO.ClH/c8-6(9)7(5-11)1-3-10-4-2-7;/h6,10-11H,1-5H2;1H.
What are the key properties of [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride?
[4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride has a molecular weight of 201.64 g/mol, XLogP of 1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethyl)piperidin-4-yl]methanol;hydrochloride is sourced from PubChem (CID 155859027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).