N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide

C7H10N4O2 — CID 135431274

IUPACN'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide
SMILESCC(=O)NNc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C7H10N4O2/c1-4-3-6(13)9-7(8-4)11-10-5(2)12/h3H,1-2H3,(H,10,12)(H2,8,9,11,13)
InChIKeyHSQHYGMRVXMHAW-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.46
Rot. Bonds2

About N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide

N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide (PubChem CID 135431274) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide.

Molecular Properties

Compound NameN'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide
PubChem CID135431274
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC NameN'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide
SMILESCC(=O)NNc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C7H10N4O2/c1-4-3-6(13)9-7(8-4)11-10-5(2)12/h3H,1-2H3,(H,10,12)(H2,8,9,11,13)
InChIKeyHSQHYGMRVXMHAW-UHFFFAOYSA-N
XLogP-0.46
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide?
The IUPAC name of N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide (CID 135431274) is N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide.
What is the SMILES notation for N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide?
The canonical SMILES for N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide is CC(=O)NNc1nc(C)cc(=O)[nH]1.
What is the InChIKey of N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide?
The InChIKey is HSQHYGMRVXMHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-4-3-6(13)9-7(8-4)11-10-5(2)12/h3H,1-2H3,(H,10,12)(H2,8,9,11,13).
What are the key properties of N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide?
N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide has a molecular weight of 182.18 g/mol, XLogP of -0.46, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetohydrazide is sourced from PubChem (CID 135431274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).