(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide

C10H13N3O — CID 89361397

IUPAC(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide
SMILESCC(=C/N)/C(N)=N/c1cccc(O)c1
InChIInChI=1S/C10H13N3O/c1-7(6-11)10(12)13-8-3-2-4-9(14)5-8/h2-6,14H,11H2,1H3,(H2,12,13)/b7-6-
InChIKeyBPBLZDYBNCAPPU-SREVYHEPSA-N
MW191.23 g/mol
LogP1.24
Rot. Bonds2

About (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide

(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide (PubChem CID 89361397) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide.

Molecular Properties

Compound Name(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide
PubChem CID89361397
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide
SMILESCC(=C/N)/C(N)=N/c1cccc(O)c1
InChIInChI=1S/C10H13N3O/c1-7(6-11)10(12)13-8-3-2-4-9(14)5-8/h2-6,14H,11H2,1H3,(H2,12,13)/b7-6-
InChIKeyBPBLZDYBNCAPPU-SREVYHEPSA-N
XLogP1.24
TPSA84.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-hydroxyphenyl)ethanimidamide
CID 10681010
(Z)-3-amino-N'-(3,5-dimethylphenyl)-2-methylprop-2-enimidamide
CID 89361275
(Z)-3-amino-N'-(4-chlorophenyl)-2-methylprop-2-enimidamide
CID 89361248
CID 54579207
CID 54579207
3-[(3-aminophenyl)diazenyl]phenol
CID 134818875
CID 54579206
CID 54579206
(Z)-N'-(3,4-dichlorophenyl)-2-methylbut-2-enimidamide
CID 5355729
3-[(Z)-2-aminoprop-1-enyl]phenol
CID 145337381
N'-[3-(1-hydroxyethyl)phenyl]ethanimidamide
CID 10729965
methyl N-cyano-N'-(3-hydroxyphenyl)carbamimidothioate
CID 12622372
3-aminophenol;benzene-1,3-diol;ethane
CID 142022536
(Z)-2-acetyl-3-hydroxy-N'-phenylbut-2-enimidamide
CID 137183212

Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide?
The IUPAC name of (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide (CID 89361397) is (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide.
What is the SMILES notation for (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide?
The canonical SMILES for (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide is CC(=C/N)/C(N)=N/c1cccc(O)c1.
What is the InChIKey of (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide?
The InChIKey is BPBLZDYBNCAPPU-SREVYHEPSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7(6-11)10(12)13-8-3-2-4-9(14)5-8/h2-6,14H,11H2,1H3,(H2,12,13)/b7-6-.
What are the key properties of (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide?
(Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide has a molecular weight of 191.23 g/mol, XLogP of 1.24, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N'-(3-hydroxyphenyl)-2-methylprop-2-enimidamide is sourced from PubChem (CID 89361397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).