ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone

C12H25NO2 — CID 143709835

IUPACethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone
SMILESCC.CC(C)C1CCN(C(=O)CO)CC1
InChIInChI=1S/C10H19NO2.C2H6/c1-8(2)9-3-5-11(6-4-9)10(13)7-12;1-2/h8-9,12H,3-7H2,1-2H3;1-2H3
InChIKeyQULVKINHGVMVJH-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.90
Rot. Bonds2

About ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone

ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone (PubChem CID 143709835) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Nameethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone
PubChem CID143709835
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Nameethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone
SMILESCC.CC(C)C1CCN(C(=O)CO)CC1
InChIInChI=1S/C10H19NO2.C2H6/c1-8(2)9-3-5-11(6-4-9)10(13)7-12;1-2/h8-9,12H,3-7H2,1-2H3;1-2H3
InChIKeyQULVKINHGVMVJH-UHFFFAOYSA-N
XLogP1.90
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 20811818
2-(methylamino)-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 59542495
5-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one
CID 103503955
2-cyclohexyl-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 155469719
2-hydroxy-1-(4-methylpiperidin-1-yl)ethanone;propane
CID 153363552
2-hydroxy-1-(4-methylpiperidin-1-yl)ethanone
CID 16769494
1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 12791779
3-oxo-3-(4-propan-2-ylpiperidin-1-yl)propanenitrile
CID 58641605
2-hydroxy-1-(4-propylpiperidin-1-yl)ethanone
CID 143775534
ethane;2-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 145315809
2-chloro-1-[4-(1-hydroxyethyl)piperidin-1-yl]ethanone
CID 103881627
ethane;methyl 4-propan-2-ylpiperidine-1-carboxylate
CID 143709693

Frequently Asked Questions

What is the IUPAC name of ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone?
The IUPAC name of ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone (CID 143709835) is ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone.
What is the SMILES notation for ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone?
The canonical SMILES for ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone is CC.CC(C)C1CCN(C(=O)CO)CC1.
What is the InChIKey of ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone?
The InChIKey is QULVKINHGVMVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.C2H6/c1-8(2)9-3-5-11(6-4-9)10(13)7-12;1-2/h8-9,12H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone?
ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone has a molecular weight of 215.34 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-hydroxy-1-(4-propan-2-ylpiperidin-1-yl)ethanone is sourced from PubChem (CID 143709835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).