N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide

C8H11N5O — CID 142223720

IUPACN-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide
SMILES[H]/N=C(\N=N\N)c1ccc(NOC)cc1
InChIInChI=1S/C8H11N5O/c1-14-12-7-4-2-6(3-5-7)8(9)11-13-10/h2-5,12H,1H3,(H3,9,10,11)
InChIKeyYBGYROQSFCZWHW-UHFFFAOYSA-N
MW193.21 g/mol
LogP1.31
Rot. Bonds3

About N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide

N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide (PubChem CID 142223720) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide.

Molecular Properties

Compound NameN-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide
PubChem CID142223720
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC NameN-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide
SMILES[H]/N=C(\N=N\N)c1ccc(NOC)cc1
InChIInChI=1S/C8H11N5O/c1-14-12-7-4-2-6(3-5-7)8(9)11-13-10/h2-5,12H,1H3,(H3,9,10,11)
InChIKeyYBGYROQSFCZWHW-UHFFFAOYSA-N
XLogP1.31
TPSA95.85 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-N,4-N-dihydrazinylidenebenzene-1,4-dicarboximidamide
CID 167095813
4-ethyl-N-hydrazinylidenebenzenecarboximidamide
CID 89361259
4-(N-hydrazinylidenecarbamimidoyl)-N-(4-phenoxyphenyl)benzamide
CID 142911150
3-amino-N-hydrazinylidenebenzenecarboximidamide
CID 123350949
4-(methoxyamino)benzoic acid
CID 58668568
3-(benzylamino)-N-hydrazinylidenebenzenecarboximidamide
CID 142938740
4-N-methoxy-1-N-methylbenzene-1,4-diamine
CID 87142473
benzene;N-methoxyaniline
CID 159505017
methyl 4-(N-formylcarbamimidoyl)benzoate
CID 154314723
9-[(2-chlorophenyl)methyl]-N-hydrazinylidenecarbazole-3-carboximidamide
CID 142223725
4-N-methoxy-1-N-phenylbenzene-1,4-diamine
CID 23137119
6-(3,4-dichlorophenyl)-N-hydrazinylidene-5-(methoxymethyl)pyrimidine-4-carboximidamide
CID 144518964

Frequently Asked Questions

What is the IUPAC name of N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide?
The IUPAC name of N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide (CID 142223720) is N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide.
What is the SMILES notation for N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide?
The canonical SMILES for N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide is [H]/N=C(\N=N\N)c1ccc(NOC)cc1.
What is the InChIKey of N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide?
The InChIKey is YBGYROQSFCZWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-14-12-7-4-2-6(3-5-7)8(9)11-13-10/h2-5,12H,1H3,(H3,9,10,11).
What are the key properties of N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide?
N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide has a molecular weight of 193.21 g/mol, XLogP of 1.31, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydrazinylidene-4-(methoxyamino)benzenecarboximidamide is sourced from PubChem (CID 142223720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).