N-hydroxy-N'-(3-methylphenyl)methanimidamide

C8H10N2O — CID 20763605

IUPACN-hydroxy-N'-(3-methylphenyl)methanimidamide
SMILESCc1cccc(/N=C/NO)c1
InChIInChI=1S/C8H10N2O/c1-7-3-2-4-8(5-7)9-6-10-11/h2-6,11H,1H3,(H,9,10)
InChIKeyHZVBLESPVYQRBP-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.63
Rot. Bonds2

About N-hydroxy-N'-(3-methylphenyl)methanimidamide

N-hydroxy-N'-(3-methylphenyl)methanimidamide (PubChem CID 20763605) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is N-hydroxy-N'-(3-methylphenyl)methanimidamide.

Molecular Properties

Compound NameN-hydroxy-N'-(3-methylphenyl)methanimidamide
PubChem CID20763605
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC NameN-hydroxy-N'-(3-methylphenyl)methanimidamide
SMILESCc1cccc(/N=C/NO)c1
InChIInChI=1S/C8H10N2O/c1-7-3-2-4-8(5-7)9-6-10-11/h2-6,11H,1H3,(H,9,10)
InChIKeyHZVBLESPVYQRBP-UHFFFAOYSA-N
XLogP1.63
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

N-hydroxy-N'-[3-(trifluoromethyl)phenyl]methanimidamide
CID 20763507
N-hydroxy-N'-(3-methylsulfanylphenyl)methanimidamide
CID 20763498
N'-(3-methylphenyl)methanimidamide
CID 55300494
N-hydroxy-N'-[3-(trifluoromethylsulfanyl)phenyl]methanimidamide
CID 20763508
2-[(3-methylphenyl)iminomethyl]benzene-1,4-diol
CID 173347602
ethane;N-hydroxy-N'-(4-methyl-2-pyridinyl)methanimidamide
CID 170575859
N-(3-methylphenyl)-1-thiophen-2-ylmethanimine
CID 13481551
N-hydroxy-4-methyl-N'-(3-methylphenyl)benzenecarboximidamide
CID 12966219
1-(4-methylphenyl)-3-(3-methylphenyl)iminopropan-1-one
CID 4131662
N'-(2,3-dihydro-1H-benzotriazol-5-yl)-N-hydroxymethanimidamide
CID 142061924
4-[(3-methylphenyl)iminomethyl]-2-phenyl-1,3-oxazol-5-ol
CID 571302
N-hydroxy-N'-[4-[(E)-2-phenylethenyl]phenyl]methanimidamide
CID 20763591

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N'-(3-methylphenyl)methanimidamide?
The IUPAC name of N-hydroxy-N'-(3-methylphenyl)methanimidamide (CID 20763605) is N-hydroxy-N'-(3-methylphenyl)methanimidamide.
What is the SMILES notation for N-hydroxy-N'-(3-methylphenyl)methanimidamide?
The canonical SMILES for N-hydroxy-N'-(3-methylphenyl)methanimidamide is Cc1cccc(/N=C/NO)c1.
What is the InChIKey of N-hydroxy-N'-(3-methylphenyl)methanimidamide?
The InChIKey is HZVBLESPVYQRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-7-3-2-4-8(5-7)9-6-10-11/h2-6,11H,1H3,(H,9,10).
What are the key properties of N-hydroxy-N'-(3-methylphenyl)methanimidamide?
N-hydroxy-N'-(3-methylphenyl)methanimidamide has a molecular weight of 150.18 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N'-(3-methylphenyl)methanimidamide is sourced from PubChem (CID 20763605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).