(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one

C7H13NO2 — CID 125181047

IUPAC(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one
SMILESC[C@@]1(CO)CCC(=O)NC1
InChIInChI=1S/C7H13NO2/c1-7(5-9)3-2-6(10)8-4-7/h9H,2-5H2,1H3,(H,8,10)/t7-/m1/s1
InChIKeyRZXLROKODJZSHO-SSDOTTSWSA-N
MW143.19 g/mol
LogP-0.10
Rot. Bonds1

About (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one

(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one (PubChem CID 125181047) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one.

Molecular Properties

Compound Name(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one
PubChem CID125181047
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one
SMILESC[C@@]1(CO)CCC(=O)NC1
InChIInChI=1S/C7H13NO2/c1-7(5-9)3-2-6(10)8-4-7/h9H,2-5H2,1H3,(H,8,10)/t7-/m1/s1
InChIKeyRZXLROKODJZSHO-SSDOTTSWSA-N
XLogP-0.10
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-benzyl-5-methylpiperidin-2-one
CID 102737184
3-ethyl-6-oxopiperidine-3-carboxylic acid
CID 83529536
5-(hydroxymethyl)-5-methyloxan-2-one
CID 172868556
4-ethyl-4-methylpyrrolidin-2-one
CID 18784903
5-(aminomethyl)-5-propylpiperidin-2-one
CID 83529483
(4S)-4-methyl-7-oxoazepane-4-carboxylic acid
CID 99985735
5-cyclopentyl-5-methylpiperidin-2-one
CID 102737198
4-methyl-4-propylpyrrolidin-2-one
CID 66106736
2,2-dimethyl-1,4-diazepan-5-one
CID 84648780
9-propan-2-yl-2-azaspiro[5.5]undecan-3-one
CID 102737321
(3-methylpiperidin-3-yl)methanol
CID 19594566
2-azaspiro[5.7]tridecan-3-one
CID 102737265

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one?
The IUPAC name of (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one (CID 125181047) is (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one.
What is the SMILES notation for (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one?
The canonical SMILES for (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one is C[C@@]1(CO)CCC(=O)NC1.
What is the InChIKey of (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one?
The InChIKey is RZXLROKODJZSHO-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H13NO2/c1-7(5-9)3-2-6(10)8-4-7/h9H,2-5H2,1H3,(H,8,10)/t7-/m1/s1.
What are the key properties of (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one?
(5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one has a molecular weight of 143.19 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(hydroxymethyl)-5-methylpiperidin-2-one is sourced from PubChem (CID 125181047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).