2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide

C14H14N4O — CID 91233246

IUPAC2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide
SMILESO=C(/C=N/c1ccccc1)NNCc1ccncc1
InChIInChI=1S/C14H14N4O/c19-14(11-16-13-4-2-1-3-5-13)18-17-10-12-6-8-15-9-7-12/h1-9,11,17H,10H2,(H,18,19)/b16-11+
InChIKeyVBNDBWKPNYTVJI-LFIBNONCSA-N
MW254.29 g/mol
LogP1.60
Rot. Bonds5

About 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide

2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide (PubChem CID 91233246) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide.

Molecular Properties

Compound Name2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide
PubChem CID91233246
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide
SMILESO=C(/C=N/c1ccccc1)NNCc1ccncc1
InChIInChI=1S/C14H14N4O/c19-14(11-16-13-4-2-1-3-5-13)18-17-10-12-6-8-15-9-7-12/h1-9,11,17H,10H2,(H,18,19)/b16-11+
InChIKeyVBNDBWKPNYTVJI-LFIBNONCSA-N
XLogP1.60
TPSA66.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chlorophenyl)imino-N'-(pyridin-4-ylmethyl)acetohydrazide
CID 91174141
N'-(pyridin-4-ylmethyl)-2-[3-[4-(trifluoromethoxy)phenoxy]phenyl]iminoacetohydrazide
CID 91021275
N'-(pyridin-4-ylmethyl)octadecanehydrazide
CID 154115968
2-oxo-N-(pyridin-4-ylmethyl)acetamide
CID 88952293
2-phenyl-N-[4-(pyridin-4-ylmethylamino)phenyl]acetamide
CID 112983139
2-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 82130126
N'-benzylpyridine-2-carbohydrazide;hydrobromide
CID 163533434
2,6-dihydroxy-N-(pyridin-4-ylmethyl)benzamide
CID 113254463
N-benzylpyridine-4-carboxamide;hydrochloride
CID 110755427
(pyridin-3-ylmethylamino)carbamic acid
CID 154450692
(Z)-3-(2-fluorophenyl)-N-(pyridin-4-ylmethyl)but-2-enamide
CID 86836437
N'-benzyl-4-(trifluoromethyl)pyridine-3-carbohydrazide
CID 139983814

Frequently Asked Questions

What is the IUPAC name of 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide?
The IUPAC name of 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide (CID 91233246) is 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide.
What is the SMILES notation for 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide?
The canonical SMILES for 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide is O=C(/C=N/c1ccccc1)NNCc1ccncc1.
What is the InChIKey of 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide?
The InChIKey is VBNDBWKPNYTVJI-LFIBNONCSA-N. The full InChI is InChI=1S/C14H14N4O/c19-14(11-16-13-4-2-1-3-5-13)18-17-10-12-6-8-15-9-7-12/h1-9,11,17H,10H2,(H,18,19)/b16-11+.
What are the key properties of 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide?
2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide has a molecular weight of 254.29 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylimino-N'-(pyridin-4-ylmethyl)acetohydrazide is sourced from PubChem (CID 91233246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).