(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide

C11H14N2O2 — CID 135071457

IUPAC(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide
SMILESCC/C=C(\C)C(=O)/N=c1\ccccn1O
InChIInChI=1S/C11H14N2O2/c1-3-6-9(2)11(14)12-10-7-4-5-8-13(10)15/h4-8,15H,3H2,1-2H3/b9-6+,12-10+
InChIKeyORWSEBVFBFEHTG-LWGDNYCUSA-N
MW206.25 g/mol
LogP1.51
Rot. Bonds2

About (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide

(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide (PubChem CID 135071457) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide.

Molecular Properties

Compound Name(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide
PubChem CID135071457
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide
SMILESCC/C=C(\C)C(=O)/N=c1\ccccn1O
InChIInChI=1S/C11H14N2O2/c1-3-6-9(2)11(14)12-10-7-4-5-8-13(10)15/h4-8,15H,3H2,1-2H3/b9-6+,12-10+
InChIKeyORWSEBVFBFEHTG-LWGDNYCUSA-N
XLogP1.51
TPSA54.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(1-hydroxy-5-methyl-2-pyridinylidene)-2,2-dimethylpropanamide
CID 10512790
N-(1-Hydroxy-5-methylpyridin-2(1H)-ylidene)acetamide
CID 295925
N-(1-hydroxy-2-pyridinylidene)-2,2-dimethylpropanamide
CID 10607848
(Z)-3-ethoxy-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide
CID 135061135
(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylbut-2-enamide
CID 135071336
2-Acetamido-4-methylpyridin-1-ium-1-olate
CID 13205643
1-(1-Hydroxy-6-methylimino-3-pyridinyl)ethanone
CID 59165922
5-Ethyl-2-pivalamidopyridine 1-oxide
CID 59272518
4-Methyl-2-pivalamidopyridine 1-oxide
CID 59272526
4-Hydroxyimidazo[1,2-a]pyridin-4-ium-7-carboxamide
CID 67163345
4-Hydroxy-7-methylimidazo[1,2-a]pyridin-4-ium-6-carboxamide
CID 67164171
3-tert-Butyl-1,8-naphthyridin-2(1H)-one 8-oxide
CID 68996499

Frequently Asked Questions

What is the IUPAC name of (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide?
The IUPAC name of (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide (CID 135071457) is (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide.
What is the SMILES notation for (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide?
The canonical SMILES for (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide is CC/C=C(\C)C(=O)/N=c1\ccccn1O.
What is the InChIKey of (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide?
The InChIKey is ORWSEBVFBFEHTG-LWGDNYCUSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-3-6-9(2)11(14)12-10-7-4-5-8-13(10)15/h4-8,15H,3H2,1-2H3/b9-6+,12-10+.
What are the key properties of (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide?
(E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide has a molecular weight of 206.25 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(1-hydroxy-2-pyridinylidene)-2-methylpent-2-enamide is sourced from PubChem (CID 135071457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).