(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine

C9H11N3O3 — CID 139991158

IUPAC(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine
SMILESCOc1cc(OC)c2oc(NN)nc2c1
InChIInChI=1S/C9H11N3O3/c1-13-5-3-6-8(7(4-5)14-2)15-9(11-6)12-10/h3-4H,10H2,1-2H3,(H,11,12)
InChIKeyREHQFGHBPCXQJQ-UHFFFAOYSA-N
MW209.20 g/mol
LogP1.13
Rot. Bonds3

About (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine

(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine (PubChem CID 139991158) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine.

Molecular Properties

Compound Name(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine
PubChem CID139991158
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine
SMILESCOc1cc(OC)c2oc(NN)nc2c1
InChIInChI=1S/C9H11N3O3/c1-13-5-3-6-8(7(4-5)14-2)15-9(11-6)12-10/h3-4H,10H2,1-2H3,(H,11,12)
InChIKeyREHQFGHBPCXQJQ-UHFFFAOYSA-N
XLogP1.13
TPSA82.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(4,6-dimethoxy-1,3-benzothiazol-2-yl)hydrazine
CID 5228893
(7-bromo-5-methyl-1,3-benzoxazol-2-yl)hydrazine
CID 82231953
1,3,6,8-tetramethoxyacridine
CID 175793272
(3-ethyl-5,7-dimethoxyquinolin-2-yl)hydrazine
CID 63233121
2-N-(5,7-dimethyl-1,3-benzoxazol-2-yl)-4-methoxy-1,3-benzothiazole-2,6-diamine
CID 50878811
2,5-dichloro-7-methoxy-1,3-benzoxazole
CID 131003018
5,7-dimethoxy-1,2-benzoxazole;titanium
CID 174490431
2-(3,5-dimethoxyphenyl)-5,7-dimethoxy-1-benzofuran
CID 10358261
(1,3-dimethoxy-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)hydrazine
CID 63351753
N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-amine
CID 43968759
[7-bromo-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]hydrazine
CID 82233963
5,7-dimethoxy-2-methylquinazolin-4-amine
CID 121232340

Frequently Asked Questions

What is the IUPAC name of (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine?
The IUPAC name of (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine (CID 139991158) is (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine.
What is the SMILES notation for (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine?
The canonical SMILES for (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine is COc1cc(OC)c2oc(NN)nc2c1.
What is the InChIKey of (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine?
The InChIKey is REHQFGHBPCXQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c1-13-5-3-6-8(7(4-5)14-2)15-9(11-6)12-10/h3-4H,10H2,1-2H3,(H,11,12).
What are the key properties of (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine?
(5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine has a molecular weight of 209.20 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5,7-dimethoxy-1,3-benzoxazol-2-yl)hydrazine is sourced from PubChem (CID 139991158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).