(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride

C8H18ClNO — CID 139026835

IUPAC(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride
SMILESCC1(C)CC(CO)CCN1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-8(2)5-7(6-10)3-4-9-8;/h7,9-10H,3-6H2,1-2H3;1H
InChIKeyFGPAIWRPGJJDCA-UHFFFAOYSA-N
MW179.69 g/mol
LogP1.18
Rot. Bonds1

About (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride

(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride (PubChem CID 139026835) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride.

Molecular Properties

Compound Name(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride
PubChem CID139026835
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride
SMILESCC1(C)CC(CO)CCN1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-8(2)5-7(6-10)3-4-9-8;/h7,9-10H,3-6H2,1-2H3;1H
InChIKeyFGPAIWRPGJJDCA-UHFFFAOYSA-N
XLogP1.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-Piperidinepropanol
CID 81497
3-(Piperidin-4-yl)propan-1-ol hydrochloride
CID 18425720
2,2,5-Trimethylpiperidin-3-ol
CID 3956268
4-(4-Piperidyl)-1-butanol hydrochloride
CID 2784667
2-(3-Methylpiperidin-4-yl)ethan-1-ol
CID 13419581
2-(Piperidin-4-yl)propan-1-ol
CID 22928829
2-(Piperidin-3-yl)ethan-1-ol hydrochloride
CID 50988804
2,2-Dimethylpiperidin-4-ol hydrochloride
CID 56924249
(3-Methylpiperidin-4-yl)methanol hydrochloride
CID 66691996
(2-Methylpiperidin-4-yl)methanol
CID 83815011
(1R)-1-(piperidin-4-yl)ethan-1-ol hydrochloride
CID 118323865
(1S)-1-(piperidin-4-yl)ethan-1-ol hydrochloride
CID 134690890

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride?
The IUPAC name of (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride (CID 139026835) is (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride.
What is the SMILES notation for (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride?
The canonical SMILES for (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride is CC1(C)CC(CO)CCN1.Cl.
What is the InChIKey of (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride?
The InChIKey is FGPAIWRPGJJDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-8(2)5-7(6-10)3-4-9-8;/h7,9-10H,3-6H2,1-2H3;1H.
What are the key properties of (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride?
(2,2-dimethylpiperidin-4-yl)methanol;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylpiperidin-4-yl)methanol;hydrochloride is sourced from PubChem (CID 139026835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).