3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide

C10H19N3O2 — CID 60961334

IUPAC3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCN1CCC(=NO)CC1
InChIInChI=1S/C10H19N3O2/c1-12(2)10(14)5-8-13-6-3-9(11-15)4-7-13/h15H,3-8H2,1-2H3
InChIKeyLCZJVOFCEOJBEM-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.39
Rot. Bonds3

About 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide

3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide (PubChem CID 60961334) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide
PubChem CID60961334
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCN1CCC(=NO)CC1
InChIInChI=1S/C10H19N3O2/c1-12(2)10(14)5-8-13-6-3-9(11-15)4-7-13/h15H,3-8H2,1-2H3
InChIKeyLCZJVOFCEOJBEM-UHFFFAOYSA-N
XLogP0.39
TPSA56.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-Piperidin-1-yl-butane-2,3-dione 2-oxime
CID 6419404
(Z)-1-(2-(hydroxyimino)-3-oxobutyl)-1-methylpiperidin-1-ium iodide
CID 9614334
2-Butanone, 3-hydroxyimino-4-piperidino-
CID 6400905
1-(4-(Hydroxyimino)piperidin-1-yl)ethanone
CID 15707988
3-Hydroxyimino-4-(1-methylpiperidin-1-ium-1-yl)butan-2-one iodide
CID 6400958
3-Hydroxyimino-4-(1-methylpiperidin-1-ium-1-yl)butan-2-one
CID 6400959
(Z)-3-(hydroxyimino)-4-(piperidin-1-yl)butan-2-one
CID 6913984
1-[2-[(2E)-2-hydroxyiminopropyl]piperidin-1-yl]ethanone
CID 5969230
1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]piperidin-1-yl]ethanone
CID 9569357
(3E)-3-hydroxyimino-4-piperidin-1-ylbutan-2-one;hydrochloride
CID 9601168
3-Hydroxyimino-4-piperidin-1-ylbutan-2-one chloride
CID 53346977
(2Z)-2-hydroxyimino-1,3-di(piperidin-1-yl)propan-1-one
CID 18172370

Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide?
The IUPAC name of 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide (CID 60961334) is 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide.
What is the SMILES notation for 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide?
The canonical SMILES for 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide is CN(C)C(=O)CCN1CCC(=NO)CC1.
What is the InChIKey of 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide?
The InChIKey is LCZJVOFCEOJBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-12(2)10(14)5-8-13-6-3-9(11-15)4-7-13/h15H,3-8H2,1-2H3.
What are the key properties of 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide?
3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide has a molecular weight of 213.28 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyiminopiperidin-1-yl)-N,N-dimethylpropanamide is sourced from PubChem (CID 60961334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).