1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone

C8H15NO2 — CID 14043899

IUPAC1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCCC[C@@H]1CO
InChIInChI=1S/C8H15NO2/c1-7(11)9-5-3-2-4-8(9)6-10/h8,10H,2-6H2,1H3/t8-/m1/s1
InChIKeyFJMSUFXIECAXGE-MRVPVSSYSA-N
MW157.21 g/mol
LogP0.38
Rot. Bonds1

About 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone

1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone (PubChem CID 14043899) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone
PubChem CID14043899
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCCC[C@@H]1CO
InChIInChI=1S/C8H15NO2/c1-7(11)9-5-3-2-4-8(9)6-10/h8,10H,2-6H2,1H3/t8-/m1/s1
InChIKeyFJMSUFXIECAXGE-MRVPVSSYSA-N
XLogP0.38
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone?
The IUPAC name of 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone (CID 14043899) is 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone is CC(=O)N1CCCC[C@@H]1CO.
What is the InChIKey of 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone?
The InChIKey is FJMSUFXIECAXGE-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7(11)9-5-3-2-4-8(9)6-10/h8,10H,2-6H2,1H3/t8-/m1/s1.
What are the key properties of 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone?
1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone has a molecular weight of 157.21 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 14043899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).