3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride

C9H20ClNO — CID 90668992

IUPAC3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride
SMILESCC1CCCNC1CCCO.Cl
InChIInChI=1S/C9H19NO.ClH/c1-8-4-2-6-10-9(8)5-3-7-11;/h8-11H,2-7H2,1H3;1H
InChIKeyKKMOFDKQNBQOLT-UHFFFAOYSA-N
MW193.72 g/mol
LogP1.57
Rot. Bonds3

About 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride

3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride (PubChem CID 90668992) has the molecular formula C9H20ClNO and a molecular weight of 193.72 g/mol. Its IUPAC name is 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride
PubChem CID90668992
Molecular FormulaC9H20ClNO
Molecular Weight193.72 g/mol
Exact Mass193.12
IUPAC Name3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride
SMILESCC1CCCNC1CCCO.Cl
InChIInChI=1S/C9H19NO.ClH/c1-8-4-2-6-10-9(8)5-3-7-11;/h8-11H,2-7H2,1H3;1H
InChIKeyKKMOFDKQNBQOLT-UHFFFAOYSA-N
XLogP1.57
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.72
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methylpiperidin-2-yl)propan-1-ol
CID 78065811
(3-methylpiperidin-2-yl)methanol;hydrochloride
CID 71756911
(3-methylpiperidin-2-yl)methanol
CID 19898861
2-(3-hydroxypropyl)piperidin-3-ol
CID 67216192
2-(3-methylpyrrolidin-2-yl)ethanol
CID 55286766
N,N-dimethyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147512
3-methyl-2-[2-(oxolan-2-yl)ethyl]piperidine
CID 106779827
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-(3-methylpiperidin-2-yl)ethanone
CID 107147574
N,N-dibutyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147528
[2-(3-hydroxypropyl)pyrrolidin-1-yl]-(3-methylpiperidin-2-yl)methanone
CID 62480452
1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone
CID 107147481
[(2S,3R)-3-methylpyrrolidin-2-yl]methanol
CID 66599997

Frequently Asked Questions

What is the IUPAC name of 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride?
The IUPAC name of 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride (CID 90668992) is 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride.
What is the SMILES notation for 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride?
The canonical SMILES for 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride is CC1CCCNC1CCCO.Cl.
What is the InChIKey of 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride?
The InChIKey is KKMOFDKQNBQOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO.ClH/c1-8-4-2-6-10-9(8)5-3-7-11;/h8-11H,2-7H2,1H3;1H.
What are the key properties of 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride?
3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride has a molecular weight of 193.72 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylpiperidin-2-yl)propan-1-ol;hydrochloride is sourced from PubChem (CID 90668992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).