2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol

C12H25NO — CID 20714163

IUPAC2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol
SMILESCC(C)(CO)C(C)(C)N1CCCCC1
InChIInChI=1S/C12H25NO/c1-11(2,10-14)12(3,4)13-8-6-5-7-9-13/h14H,5-10H2,1-4H3
InChIKeyLIAOCLZMQRUVCI-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.27
Rot. Bonds3

About 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol

2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol (PubChem CID 20714163) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol.

Molecular Properties

Compound Name2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol
PubChem CID20714163
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol
SMILESCC(C)(CO)C(C)(C)N1CCCCC1
InChIInChI=1S/C12H25NO/c1-11(2,10-14)12(3,4)13-8-6-5-7-9-13/h14H,5-10H2,1-4H3
InChIKeyLIAOCLZMQRUVCI-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)-2-methylpropane-1,3-diol
CID 104550731
2-tert-butyl-3,3-dimethyl-2-piperidin-1-ylbutan-1-ol
CID 57290446
1,6-ditert-butyl-1,6-diazacycloundecane
CID 90712737
1-tert-butylazepane;1-tert-butylpiperidine
CID 158450868
1-(2,5-dimethyl-5-pyrrolidin-1-ylhexan-2-yl)piperidine
CID 155467667
1-tert-butylpiperidine;1-tert-butylpyrrolidine;ethane
CID 160950375
3-(azocan-1-yl)-3-methylbutanoic acid
CID 164650523
2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol
CID 54776185
1-(3-ethylhexan-3-yl)piperidine
CID 156519232
2,4-dimethyl-4-piperidin-1-ylpentan-2-amine
CID 143013617
3-methyl-3-piperidin-1-ylbutanal
CID 102486553
2-methyl-2-piperidin-1-ylhexan-3-ol
CID 79045077

Frequently Asked Questions

What is the IUPAC name of 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol?
The IUPAC name of 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol (CID 20714163) is 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol.
What is the SMILES notation for 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol?
The canonical SMILES for 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol is CC(C)(CO)C(C)(C)N1CCCCC1.
What is the InChIKey of 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol?
The InChIKey is LIAOCLZMQRUVCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-11(2,10-14)12(3,4)13-8-6-5-7-9-13/h14H,5-10H2,1-4H3.
What are the key properties of 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol?
2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol has a molecular weight of 199.34 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trimethyl-3-piperidin-1-ylbutan-1-ol is sourced from PubChem (CID 20714163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).