(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide

C11H16N4O2 — CID 135455183

IUPAC(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide
SMILESCN(C)CCNC(=O)/C(=N\O)c1ccccn1
InChIInChI=1S/C11H16N4O2/c1-15(2)8-7-13-11(16)10(14-17)9-5-3-4-6-12-9/h3-6,17H,7-8H2,1-2H3,(H,13,16)/b14-10-
InChIKeyDUZRXEWYMHBFIF-UVTDQMKNSA-N
MW236.28 g/mol
LogP-0.06
Rot. Bonds5

About (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide

(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide (PubChem CID 135455183) has the molecular formula C11H16N4O2 and a molecular weight of 236.28 g/mol. Its IUPAC name is (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide.

Molecular Properties

Compound Name(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide
PubChem CID135455183
Molecular FormulaC11H16N4O2
Molecular Weight236.28 g/mol
Exact Mass236.13
IUPAC Name(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide
SMILESCN(C)CCNC(=O)/C(=N\O)c1ccccn1
InChIInChI=1S/C11H16N4O2/c1-15(2)8-7-13-11(16)10(14-17)9-5-3-4-6-12-9/h3-6,17H,7-8H2,1-2H3,(H,13,16)/b14-10-
InChIKeyDUZRXEWYMHBFIF-UVTDQMKNSA-N
XLogP-0.06
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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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Frequently Asked Questions

What is the IUPAC name of (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide?
The IUPAC name of (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide (CID 135455183) is (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide.
What is the SMILES notation for (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide?
The canonical SMILES for (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide is CN(C)CCNC(=O)/C(=N\O)c1ccccn1.
What is the InChIKey of (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide?
The InChIKey is DUZRXEWYMHBFIF-UVTDQMKNSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-15(2)8-7-13-11(16)10(14-17)9-5-3-4-6-12-9/h3-6,17H,7-8H2,1-2H3,(H,13,16)/b14-10-.
What are the key properties of (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide?
(2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide has a molecular weight of 236.28 g/mol, XLogP of -0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-[2-(dimethylamino)ethyl]-2-hydroxyimino-2-pyridin-2-ylacetamide is sourced from PubChem (CID 135455183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).