2-amino-4,5-dimethoxy-N-methylbenzohydrazide

C10H15N3O3 — CID 145124941

IUPAC2-amino-4,5-dimethoxy-N-methylbenzohydrazide
SMILESCOc1cc(N)c(C(=O)N(C)N)cc1OC
InChIInChI=1S/C10H15N3O3/c1-13(12)10(14)6-4-8(15-2)9(16-3)5-7(6)11/h4-5H,11-12H2,1-3H3
InChIKeyCASLEZOWLRTSOF-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.23
Rot. Bonds3

About 2-amino-4,5-dimethoxy-N-methylbenzohydrazide

2-amino-4,5-dimethoxy-N-methylbenzohydrazide (PubChem CID 145124941) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-amino-4,5-dimethoxy-N-methylbenzohydrazide.

Molecular Properties

Compound Name2-amino-4,5-dimethoxy-N-methylbenzohydrazide
PubChem CID145124941
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name2-amino-4,5-dimethoxy-N-methylbenzohydrazide
SMILESCOc1cc(N)c(C(=O)N(C)N)cc1OC
InChIInChI=1S/C10H15N3O3/c1-13(12)10(14)6-4-8(15-2)9(16-3)5-7(6)11/h4-5H,11-12H2,1-3H3
InChIKeyCASLEZOWLRTSOF-UHFFFAOYSA-N
XLogP0.23
TPSA90.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N,N-diethyl-4,5-dimethoxybenzamide
CID 16776188
2-amino-N-[3-(dimethylamino)propyl]-4,5-dimethoxy-N-methylbenzamide
CID 63695458
2-methoxy-N,5-dimethylbenzohydrazide
CID 116845575
2-amino-N-hydroxy-4,5-dimethoxybenzamide
CID 11535831
1-(2-amino-4,5-dimethoxyphenyl)ethanone;hydrobromide
CID 172866698
2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide
CID 61118260
2-amino-N-cyclopropyl-4,5-dimethoxy-N-(2-methylpropyl)benzamide
CID 61107611
2-amino-4,5-dimethoxy-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 82183835
2-amino-N-cyclopropyl-N-ethyl-4,5-dimethoxybenzamide
CID 43263713
1-(2-amino-4,5-dimethoxyphenyl)propan-1-one
CID 7148511
nitro 2-amino-4,5-dimethoxybenzoate
CID 174871974
2-amino-N-(furan-2-ylmethyl)-4,5-dimethoxy-N-methylbenzamide
CID 43526528

Frequently Asked Questions

What is the IUPAC name of 2-amino-4,5-dimethoxy-N-methylbenzohydrazide?
The IUPAC name of 2-amino-4,5-dimethoxy-N-methylbenzohydrazide (CID 145124941) is 2-amino-4,5-dimethoxy-N-methylbenzohydrazide.
What is the SMILES notation for 2-amino-4,5-dimethoxy-N-methylbenzohydrazide?
The canonical SMILES for 2-amino-4,5-dimethoxy-N-methylbenzohydrazide is COc1cc(N)c(C(=O)N(C)N)cc1OC.
What is the InChIKey of 2-amino-4,5-dimethoxy-N-methylbenzohydrazide?
The InChIKey is CASLEZOWLRTSOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-13(12)10(14)6-4-8(15-2)9(16-3)5-7(6)11/h4-5H,11-12H2,1-3H3.
What are the key properties of 2-amino-4,5-dimethoxy-N-methylbenzohydrazide?
2-amino-4,5-dimethoxy-N-methylbenzohydrazide has a molecular weight of 225.25 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4,5-dimethoxy-N-methylbenzohydrazide is sourced from PubChem (CID 145124941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).