2,3-dihydroxy-N-methylbenzohydrazide

C8H10N2O3 — CID 142945868

IUPAC2,3-dihydroxy-N-methylbenzohydrazide
SMILESCN(N)C(=O)c1cccc(O)c1O
InChIInChI=1S/C8H10N2O3/c1-10(9)8(13)5-3-2-4-6(11)7(5)12/h2-4,11-12H,9H2,1H3
InChIKeyHZZOCYRTZJMMKV-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.04
Rot. Bonds1

About 2,3-dihydroxy-N-methylbenzohydrazide

2,3-dihydroxy-N-methylbenzohydrazide (PubChem CID 142945868) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2,3-dihydroxy-N-methylbenzohydrazide.

Molecular Properties

Compound Name2,3-dihydroxy-N-methylbenzohydrazide
PubChem CID142945868
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name2,3-dihydroxy-N-methylbenzohydrazide
SMILESCN(N)C(=O)c1cccc(O)c1O
InChIInChI=1S/C8H10N2O3/c1-10(9)8(13)5-3-2-4-6(11)7(5)12/h2-4,11-12H,9H2,1H3
InChIKeyHZZOCYRTZJMMKV-UHFFFAOYSA-N
XLogP0.04
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,3-dihydroxy-N-methoxy-N-methylbenzamide
CID 114344880
N,N-diethyl-2,3-dihydroxybenzamide
CID 15178612
N-(2-carbamothioylphenyl)-2,3-dihydroxy-N-methylbenzamide
CID 114343651
N,2-dimethylbenzohydrazide;hydrochloride
CID 21321934
2,3-dihydroxy-N-methyl-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 114343941
N-ethyl-2,3-dihydroxy-N-propan-2-ylbenzamide
CID 114343923
2-[(2,3-dihydroxybenzoyl)-(2-methylpropyl)amino]acetic acid
CID 114343332
N-(3-bromobutyl)-2,3-dihydroxy-N-methylbenzamide
CID 114345365
N-ethyl-2,3-dihydroxy-N-phenylbenzamide
CID 114343845
3-fluoro-N-methyl-2-(trifluoromethyl)benzohydrazide
CID 178112374
2,3-dihydroxybenzoyl bromide
CID 141115203
N,N-bis(cyclopropylmethyl)-2,3-dihydroxybenzamide
CID 114344418

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-N-methylbenzohydrazide?
The IUPAC name of 2,3-dihydroxy-N-methylbenzohydrazide (CID 142945868) is 2,3-dihydroxy-N-methylbenzohydrazide.
What is the SMILES notation for 2,3-dihydroxy-N-methylbenzohydrazide?
The canonical SMILES for 2,3-dihydroxy-N-methylbenzohydrazide is CN(N)C(=O)c1cccc(O)c1O.
What is the InChIKey of 2,3-dihydroxy-N-methylbenzohydrazide?
The InChIKey is HZZOCYRTZJMMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-10(9)8(13)5-3-2-4-6(11)7(5)12/h2-4,11-12H,9H2,1H3.
What are the key properties of 2,3-dihydroxy-N-methylbenzohydrazide?
2,3-dihydroxy-N-methylbenzohydrazide has a molecular weight of 182.18 g/mol, XLogP of 0.04, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-N-methylbenzohydrazide is sourced from PubChem (CID 142945868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).