(3S)-3-methylpiperidin-3-ol;hydrochloride

C6H14ClNO — CID 138393705

IUPAC(3S)-3-methylpiperidin-3-ol;hydrochloride
SMILESC[C@]1(O)CCCNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-6(8)3-2-4-7-5-6;/h7-8H,2-5H2,1H3;1H/t6-;/m0./s1
InChIKeyNSCBVPULCFBFGX-RGMNGODLSA-N
MW151.64 g/mol
LogP0.54
Rot. Bonds

About (3S)-3-methylpiperidin-3-ol;hydrochloride

(3S)-3-methylpiperidin-3-ol;hydrochloride (PubChem CID 138393705) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is (3S)-3-methylpiperidin-3-ol;hydrochloride.

Molecular Properties

Compound Name(3S)-3-methylpiperidin-3-ol;hydrochloride
PubChem CID138393705
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name(3S)-3-methylpiperidin-3-ol;hydrochloride
SMILESC[C@]1(O)CCCNC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-6(8)3-2-4-7-5-6;/h7-8H,2-5H2,1H3;1H/t6-;/m0./s1
InChIKeyNSCBVPULCFBFGX-RGMNGODLSA-N
XLogP0.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

lithium 1-methylcyclopentan-1-ol
CID 18764027
(3-methylpiperidin-3-yl)methanol
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(3S)-3-fluoro-3-methylpiperidine
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3-(2-methylprop-1-enyl)piperidin-3-ol
CID 79190008
(8E)-6-methyl-1-azacyclododec-8-en-6-ol
CID 163651300
1-(3-aminopiperidin-3-yl)-4,4-dimethylcyclohexan-1-ol
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3,4-dimethylazepan-4-ol;hydrochloride
CID 118798621
cyclobutanol;3,3-dimethylpiperidine
CID 166077953
acetylene;1-methylcyclohexan-1-ol
CID 142432034
N,N,3-trimethylpiperidin-3-amine
CID 117000006
[3-(hydroxymethyl)piperidin-3-yl]methanol;hydrochloride
CID 146121139
3-[[ethyl(methyl)amino]methyl]piperidin-3-ol
CID 126971368

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methylpiperidin-3-ol;hydrochloride?
The IUPAC name of (3S)-3-methylpiperidin-3-ol;hydrochloride (CID 138393705) is (3S)-3-methylpiperidin-3-ol;hydrochloride.
What is the SMILES notation for (3S)-3-methylpiperidin-3-ol;hydrochloride?
The canonical SMILES for (3S)-3-methylpiperidin-3-ol;hydrochloride is C[C@]1(O)CCCNC1.Cl.
What is the InChIKey of (3S)-3-methylpiperidin-3-ol;hydrochloride?
The InChIKey is NSCBVPULCFBFGX-RGMNGODLSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-6(8)3-2-4-7-5-6;/h7-8H,2-5H2,1H3;1H/t6-;/m0./s1.
What are the key properties of (3S)-3-methylpiperidin-3-ol;hydrochloride?
(3S)-3-methylpiperidin-3-ol;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methylpiperidin-3-ol;hydrochloride is sourced from PubChem (CID 138393705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).