N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide

C15H14N4O3 — CID 2248739

IUPACN'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide
SMILESO=C(NCc1ccccn1)C(=O)NN=Cc1ccccc1O
InChIInChI=1S/C15H14N4O3/c20-13-7-2-1-5-11(13)9-18-19-15(22)14(21)17-10-12-6-3-4-8-16-12/h1-9,20H,10H2,(H,17,21)(H,19,22)
InChIKeyZCDFGGVENWWLQQ-UHFFFAOYSA-N
MW298.30 g/mol
LogP0.55
Rot. Bonds4

About N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide

N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide (PubChem CID 2248739) has the molecular formula C15H14N4O3 and a molecular weight of 298.30 g/mol. Its IUPAC name is N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide.

Molecular Properties

Compound NameN'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide
PubChem CID2248739
Molecular FormulaC15H14N4O3
Molecular Weight298.30 g/mol
Exact Mass298.11
IUPAC NameN'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide
SMILESO=C(NCc1ccccn1)C(=O)NN=Cc1ccccc1O
InChIInChI=1S/C15H14N4O3/c20-13-7-2-1-5-11(13)9-18-19-15(22)14(21)17-10-12-6-3-4-8-16-12/h1-9,20H,10H2,(H,17,21)(H,19,22)
InChIKeyZCDFGGVENWWLQQ-UHFFFAOYSA-N
XLogP0.55
TPSA103.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[(Z)-(2-hydroxyphenyl)methylideneamino]-N-(pyridin-4-ylmethyl)oxamide
CID 137122638
4-[[[2-oxo-2-(pyridin-2-ylmethylamino)acetyl]hydrazinylidene]methyl]benzoic acid
CID 2850530
N'-[(E)-(2-hydroxyphenyl)methylideneamino]-N-methyloxamide
CID 135531553
2-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-N-pyridin-2-yl-2-sulfanylideneacetamide
CID 135938483
N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(pyridin-2-ylmethyl)oxamide
CID 7103785
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]oxamide
CID 71676617
N-(2-aminoethyl)-N'-(pyridin-2-ylmethyl)oxamide
CID 43315841
N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(pyridin-4-ylmethyl)oxamide
CID 126191968
2-methyl-N-(pyridin-2-ylmethyl)prop-2-enamide
CID 142012577
2-(hydroxyamino)-N-(pyridin-2-ylmethyl)prop-2-enamide
CID 3676320
benzene-1,2-diol;oxovanadium;2-(pyridin-2-ylmethyliminomethyl)phenol
CID 171438202
N,N'-bis[(2,3-dihydroxyphenyl)methylideneamino]oxamide
CID 5041852

Frequently Asked Questions

What is the IUPAC name of N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide?
The IUPAC name of N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide (CID 2248739) is N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide.
What is the SMILES notation for N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide?
The canonical SMILES for N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide is O=C(NCc1ccccn1)C(=O)NN=Cc1ccccc1O.
What is the InChIKey of N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide?
The InChIKey is ZCDFGGVENWWLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3/c20-13-7-2-1-5-11(13)9-18-19-15(22)14(21)17-10-12-6-3-4-8-16-12/h1-9,20H,10H2,(H,17,21)(H,19,22).
What are the key properties of N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide?
N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide has a molecular weight of 298.30 g/mol, XLogP of 0.55, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2-hydroxyphenyl)methylideneamino]-N-(pyridin-2-ylmethyl)oxamide is sourced from PubChem (CID 2248739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).