N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide

C8H12N4O — CID 685250

IUPACN'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide
SMILESCC(=O)NNc1nc(C)cc(C)n1
InChIInChI=1S/C8H12N4O/c1-5-4-6(2)10-8(9-5)12-11-7(3)13/h4H,1-3H3,(H,11,13)(H,9,10,12)
InChIKeyJEJNMUAFUCSXCU-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.56
Rot. Bonds2

About N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide

N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide (PubChem CID 685250) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide.

Molecular Properties

Compound NameN'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide
PubChem CID685250
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC NameN'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide
SMILESCC(=O)NNc1nc(C)cc(C)n1
InChIInChI=1S/C8H12N4O/c1-5-4-6(2)10-8(9-5)12-11-7(3)13/h4H,1-3H3,(H,11,13)(H,9,10,12)
InChIKeyJEJNMUAFUCSXCU-UHFFFAOYSA-N
XLogP0.56
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]acetohydrazide
CID 668161
2-Hydrazinyl-4,6-dimethylpyrimidine
CID 350535
N-(Cyclopentylideneamino)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide
CID 696369
1-[(4,6-Dimethylpyrimidin-2-yl)amino]pyrrole-2,5-dione
CID 2028070
2-(4,6-Dimethylpyrimidin-2-yl)acetamide
CID 659932
1-Cyclohexyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]urea
CID 2350131
N-(cyclopentylideneamino)-4,6-dimethylpyrimidin-2-amine
CID 4124270
N'-(2-amino-6-methylpyrimidin-4-yl)acetohydrazide
CID 828068
N'-(2-amino-6-methylpyrimidin-4-yl)-N,N'-dimethylacetohydrazide
CID 911008
2-(4,6-dimethylpyrimidin-2-yl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
CID 4890845
2-(4,6-Dimethylpyrimidin-2-yl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
CID 12771908
Urea, (4,6-dimethyl-2-pyrimidinyl)-
CID 156499

Frequently Asked Questions

What is the IUPAC name of N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide?
The IUPAC name of N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide (CID 685250) is N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide.
What is the SMILES notation for N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide?
The canonical SMILES for N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide is CC(=O)NNc1nc(C)cc(C)n1.
What is the InChIKey of N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide?
The InChIKey is JEJNMUAFUCSXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-5-4-6(2)10-8(9-5)12-11-7(3)13/h4H,1-3H3,(H,11,13)(H,9,10,12).
What are the key properties of N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide?
N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide has a molecular weight of 180.21 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,6-dimethylpyrimidin-2-yl)acetohydrazide is sourced from PubChem (CID 685250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).