2-butan-2-yl-1-hydroxypiperidine

C9H19NO — CID 15640781

IUPAC2-butan-2-yl-1-hydroxypiperidine
SMILESCCC(C)C1CCCCN1O
InChIInChI=1S/C9H19NO/c1-3-8(2)9-6-4-5-7-10(9)11/h8-9,11H,3-7H2,1-2H3
InChIKeyKSXIZRZWKXFZMK-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.28
Rot. Bonds2

About 2-butan-2-yl-1-hydroxypiperidine

2-butan-2-yl-1-hydroxypiperidine (PubChem CID 15640781) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-butan-2-yl-1-hydroxypiperidine.

Molecular Properties

Compound Name2-butan-2-yl-1-hydroxypiperidine
PubChem CID15640781
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-butan-2-yl-1-hydroxypiperidine
SMILESCCC(C)C1CCCCN1O
InChIInChI=1S/C9H19NO/c1-3-8(2)9-6-4-5-7-10(9)11/h8-9,11H,3-7H2,1-2H3
InChIKeyKSXIZRZWKXFZMK-UHFFFAOYSA-N
XLogP2.28
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Hydroxy-2,2,4,6,6-pentamethylpiperidine
CID 17824458
2,2,6,6-Tetramethyl-4-ethyl-hydroxypiperidine
CID 17824478
Hydroxy-8-methyldecahydroquinoline
CID 57709566
1-Hydroxy-2-pentylpiperidine
CID 68416103
Trimethylpiperidol
CID 91453137
3-Fluoro-9-hydroxy-7-methyl-9-azabicyclo[3.3.1]nonane
CID 129155559
1-Fluoro-9-hydroxy-3-methyl-9-azabicyclo[3.3.1]nonane
CID 129155601
4-Fluoro-2-(2-fluoro-2-methylpentyl)-1-hydroxypiperidine
CID 129155968
(3R)-1-fluoro-9-hydroxy-3-methyl-9-azabicyclo[3.3.1]nonane
CID 130291365
(3-Fluoro-7-methyl-9-azabicyclo[3.3.1]nonan-9-yl)oxidanium
CID 147270687
4-Fluoro-2-(2-fluoroethyl)-1-hydroxy-2-methyl-6-propylpiperidine
CID 166951304
2-(2,4-Difluoro-2-methylbutyl)-1-hydroxy-6-methylpiperidine
CID 166951312

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-1-hydroxypiperidine?
The IUPAC name of 2-butan-2-yl-1-hydroxypiperidine (CID 15640781) is 2-butan-2-yl-1-hydroxypiperidine.
What is the SMILES notation for 2-butan-2-yl-1-hydroxypiperidine?
The canonical SMILES for 2-butan-2-yl-1-hydroxypiperidine is CCC(C)C1CCCCN1O.
What is the InChIKey of 2-butan-2-yl-1-hydroxypiperidine?
The InChIKey is KSXIZRZWKXFZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8(2)9-6-4-5-7-10(9)11/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 2-butan-2-yl-1-hydroxypiperidine?
2-butan-2-yl-1-hydroxypiperidine has a molecular weight of 157.26 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-1-hydroxypiperidine is sourced from PubChem (CID 15640781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).