N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide

C9H12N4O — CID 22302284

IUPACN'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide
SMILESCOc1ccc(/C=N/N/N=C\N)cc1
InChIInChI=1S/C9H12N4O/c1-14-9-4-2-8(3-5-9)6-11-13-12-7-10/h2-7,13H,1H3,(H2,10,12)/b11-6+
InChIKeyRWEJZODOMDVVNR-IZZDOVSWSA-N
MW192.22 g/mol
LogP0.52
Rot. Bonds4

About N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide

N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide (PubChem CID 22302284) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide.

Molecular Properties

Compound NameN'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide
PubChem CID22302284
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC NameN'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide
SMILESCOc1ccc(/C=N/N/N=C\N)cc1
InChIInChI=1S/C9H12N4O/c1-14-9-4-2-8(3-5-9)6-11-13-12-7-10/h2-7,13H,1H3,(H2,10,12)/b11-6+
InChIKeyRWEJZODOMDVVNR-IZZDOVSWSA-N
XLogP0.52
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,3-bis[(4-methoxyphenyl)methylideneamino]thiourea
CID 712024
N,N'-bis[(E)-(4-methoxyphenyl)methylideneamino]pentanediamide
CID 6861549
1-amino-3-[(4-methoxyphenyl)methylideneamino]thiourea
CID 2728543
N'-[(4-methoxyphenyl)methylideneamino]oxamide
CID 2590460
1,2-bis[(E)-(4-methoxyphenyl)methylideneamino]guanidine
CID 54753081
1-[(E)-(4-methoxyphenyl)methylideneamino]-2-[(Z)-(4-methoxyphenyl)methylideneamino]guanidine
CID 119080623
4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]phenol
CID 135510327
N-[(E)-(4-methoxyphenyl)methylideneamino]-N'-[(Z)-(4-methoxyphenyl)methylideneamino]propanediamide
CID 44726282
(Z)-1-(4-methoxyphenyl)-N-oxidomethanimine
CID 11389669
N-methoxy-1-(4-methoxyphenyl)methanimine
CID 520640
N,N'-bis[(E)-(4-methoxyphenyl)methylideneamino]butanediamide
CID 6869271
1-(4-methoxyphenyl)-N-methylmethanimine;propane
CID 142550008

Frequently Asked Questions

What is the IUPAC name of N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide?
The IUPAC name of N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide (CID 22302284) is N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide.
What is the SMILES notation for N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide?
The canonical SMILES for N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide is COc1ccc(/C=N/N/N=C\N)cc1.
What is the InChIKey of N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide?
The InChIKey is RWEJZODOMDVVNR-IZZDOVSWSA-N. The full InChI is InChI=1S/C9H12N4O/c1-14-9-4-2-8(3-5-9)6-11-13-12-7-10/h2-7,13H,1H3,(H2,10,12)/b11-6+.
What are the key properties of N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide?
N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide has a molecular weight of 192.22 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]methanimidamide is sourced from PubChem (CID 22302284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).