3-methyl-2-piperidin-3-ylhexan-2-ol

C12H25NO — CID 107892565

IUPAC3-methyl-2-piperidin-3-ylhexan-2-ol
SMILESCCCC(C)C(C)(O)C1CCCNC1
InChIInChI=1S/C12H25NO/c1-4-6-10(2)12(3,14)11-7-5-8-13-9-11/h10-11,13-14H,4-9H2,1-3H3
InChIKeyCMFNRQKITQZAPD-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.17
Rot. Bonds4

About 3-methyl-2-piperidin-3-ylhexan-2-ol

3-methyl-2-piperidin-3-ylhexan-2-ol (PubChem CID 107892565) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 3-methyl-2-piperidin-3-ylhexan-2-ol.

Molecular Properties

Compound Name3-methyl-2-piperidin-3-ylhexan-2-ol
PubChem CID107892565
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name3-methyl-2-piperidin-3-ylhexan-2-ol
SMILESCCCC(C)C(C)(O)C1CCCNC1
InChIInChI=1S/C12H25NO/c1-4-6-10(2)12(3,14)11-7-5-8-13-9-11/h10-11,13-14H,4-9H2,1-3H3
InChIKeyCMFNRQKITQZAPD-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-piperidin-3-ylpentan-2-ol
CID 63586269
2-piperidin-3-ylbutan-2-ol
CID 63586087
2-piperidin-3-yloctan-2-ol
CID 65146111
(2S)-2-[(3R)-piperidin-3-yl]propane-1,2-diol
CID 171842996
5,5-dimethyl-2-piperidin-3-ylhexan-2-ol
CID 65146059
(3R)-3-tert-butylpiperidine
CID 59772800
2-methyl-2-piperidin-3-ylpropan-1-ol
CID 83200214
1-cycloheptyl-1-piperidin-3-ylethanol
CID 82929213
3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]hexanoic acid
CID 83200067
3-(2-fluoro-5-methoxy-3-methylpentan-2-yl)piperidine
CID 116500623
4-amino-3,3-dimethyl-2-piperidin-3-ylbutan-2-ol
CID 79135325
2-pyrrolidin-3-ylbutan-2-ol
CID 105428542

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-piperidin-3-ylhexan-2-ol?
The IUPAC name of 3-methyl-2-piperidin-3-ylhexan-2-ol (CID 107892565) is 3-methyl-2-piperidin-3-ylhexan-2-ol.
What is the SMILES notation for 3-methyl-2-piperidin-3-ylhexan-2-ol?
The canonical SMILES for 3-methyl-2-piperidin-3-ylhexan-2-ol is CCCC(C)C(C)(O)C1CCCNC1.
What is the InChIKey of 3-methyl-2-piperidin-3-ylhexan-2-ol?
The InChIKey is CMFNRQKITQZAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-6-10(2)12(3,14)11-7-5-8-13-9-11/h10-11,13-14H,4-9H2,1-3H3.
What are the key properties of 3-methyl-2-piperidin-3-ylhexan-2-ol?
3-methyl-2-piperidin-3-ylhexan-2-ol has a molecular weight of 199.34 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-piperidin-3-ylhexan-2-ol is sourced from PubChem (CID 107892565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).