N'-(hydroxymethyl)benzohydrazide

C8H10N2O2 — CID 130128548

IUPACN'-(hydroxymethyl)benzohydrazide
SMILESO=C(NNCO)c1ccccc1
InChIInChI=1S/C8H10N2O2/c11-6-9-10-8(12)7-4-2-1-3-5-7/h1-5,9,11H,6H2,(H,10,12)
InChIKeyBPZYKYMFQWOODP-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.13
Rot. Bonds3

About N'-(hydroxymethyl)benzohydrazide

N'-(hydroxymethyl)benzohydrazide (PubChem CID 130128548) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is N'-(hydroxymethyl)benzohydrazide.

Molecular Properties

Compound NameN'-(hydroxymethyl)benzohydrazide
PubChem CID130128548
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC NameN'-(hydroxymethyl)benzohydrazide
SMILESO=C(NNCO)c1ccccc1
InChIInChI=1S/C8H10N2O2/c11-6-9-10-8(12)7-4-2-1-3-5-7/h1-5,9,11H,6H2,(H,10,12)
InChIKeyBPZYKYMFQWOODP-UHFFFAOYSA-N
XLogP-0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 11195067
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bis(1,3-diphenylpropane-1,3-dione);zinc
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benzohydrazide;molybdenum
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CID 174760685
N'-(2-oxo-2-phenylacetyl)benzohydrazide
CID 12792453
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CID 89240823
N'-(2,4-dioxo-4-phenylbutanoyl)benzohydrazide
CID 4049162
benzamidothiourea
CID 781748
benzohydrazide;ethanol;hydrochloride
CID 70295048
4-[4-(benzamidocarbamoyl)phenoxy]-N'-benzoylbenzohydrazide
CID 21231530

Frequently Asked Questions

What is the IUPAC name of N'-(hydroxymethyl)benzohydrazide?
The IUPAC name of N'-(hydroxymethyl)benzohydrazide (CID 130128548) is N'-(hydroxymethyl)benzohydrazide.
What is the SMILES notation for N'-(hydroxymethyl)benzohydrazide?
The canonical SMILES for N'-(hydroxymethyl)benzohydrazide is O=C(NNCO)c1ccccc1.
What is the InChIKey of N'-(hydroxymethyl)benzohydrazide?
The InChIKey is BPZYKYMFQWOODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c11-6-9-10-8(12)7-4-2-1-3-5-7/h1-5,9,11H,6H2,(H,10,12).
What are the key properties of N'-(hydroxymethyl)benzohydrazide?
N'-(hydroxymethyl)benzohydrazide has a molecular weight of 166.18 g/mol, XLogP of -0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(hydroxymethyl)benzohydrazide is sourced from PubChem (CID 130128548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).