4-butan-2-yl-1-hydroxypiperidine

C9H19NO — CID 59870205

IUPAC4-butan-2-yl-1-hydroxypiperidine
SMILESCCC(C)C1CCN(O)CC1
InChIInChI=1S/C9H19NO/c1-3-8(2)9-4-6-10(11)7-5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyOJSLVWIPFOXUNA-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.13
Rot. Bonds2

About 4-butan-2-yl-1-hydroxypiperidine

4-butan-2-yl-1-hydroxypiperidine (PubChem CID 59870205) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-butan-2-yl-1-hydroxypiperidine.

Molecular Properties

Compound Name4-butan-2-yl-1-hydroxypiperidine
PubChem CID59870205
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-butan-2-yl-1-hydroxypiperidine
SMILESCCC(C)C1CCN(O)CC1
InChIInChI=1S/C9H19NO/c1-3-8(2)9-4-6-10(11)7-5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyOJSLVWIPFOXUNA-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

butan-2-ylcyclohexadecane
CID 123713671
butan-2-ylcyclopentane;ethane
CID 143236269
1-butan-2-yl-4-methylcyclohexane
CID 20676481
butan-2-ylcyclohexane;ethane
CID 143005290
1-butan-2-yl-4-[1-(4-propan-2-ylcyclohexyl)ethyl]cyclohexane
CID 153382511
butan-2-ylcyclohexane;ethane;propane
CID 143477078
4-[(2R)-butan-2-yl]piperidine;ethane
CID 142032949
1-(4-butan-2-ylpiperidin-1-yl)-3-ethoxypropan-2-ol
CID 126514523
2-butan-2-yl-1-hydroxypiperidine
CID 15640781
4-butan-2-ylthiane 1,1-dioxide
CID 123360092
1-butan-2-yl-4-propan-2-yloxycyclohexane
CID 23528463
2-(4-butan-2-ylpiperidin-1-yl)pyrimidine
CID 145314724

Frequently Asked Questions

What is the IUPAC name of 4-butan-2-yl-1-hydroxypiperidine?
The IUPAC name of 4-butan-2-yl-1-hydroxypiperidine (CID 59870205) is 4-butan-2-yl-1-hydroxypiperidine.
What is the SMILES notation for 4-butan-2-yl-1-hydroxypiperidine?
The canonical SMILES for 4-butan-2-yl-1-hydroxypiperidine is CCC(C)C1CCN(O)CC1.
What is the InChIKey of 4-butan-2-yl-1-hydroxypiperidine?
The InChIKey is OJSLVWIPFOXUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8(2)9-4-6-10(11)7-5-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 4-butan-2-yl-1-hydroxypiperidine?
4-butan-2-yl-1-hydroxypiperidine has a molecular weight of 157.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butan-2-yl-1-hydroxypiperidine is sourced from PubChem (CID 59870205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).