2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide

C12H13N5O — CID 47338470

IUPAC2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide
SMILESCc1ccc(CC(=O)NNc2ncccn2)cn1
InChIInChI=1S/C12H13N5O/c1-9-3-4-10(8-15-9)7-11(18)16-17-12-13-5-2-6-14-12/h2-6,8H,7H2,1H3,(H,16,18)(H,13,14,17)
InChIKeySVMSPEFDLYKOFG-UHFFFAOYSA-N
MW243.27 g/mol
LogP0.87
Rot. Bonds4

About 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide

2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide (PubChem CID 47338470) has the molecular formula C12H13N5O and a molecular weight of 243.27 g/mol. Its IUPAC name is 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide.

Molecular Properties

Compound Name2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide
PubChem CID47338470
Molecular FormulaC12H13N5O
Molecular Weight243.27 g/mol
Exact Mass243.11
IUPAC Name2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide
SMILESCc1ccc(CC(=O)NNc2ncccn2)cn1
InChIInChI=1S/C12H13N5O/c1-9-3-4-10(8-15-9)7-11(18)16-17-12-13-5-2-6-14-12/h2-6,8H,7H2,1H3,(H,16,18)(H,13,14,17)
InChIKeySVMSPEFDLYKOFG-UHFFFAOYSA-N
XLogP0.87
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(aminomethyl)pentan-3-yl]-2-(6-methyl-3-pyridinyl)acetamide
CID 119571100
N-(4-ethylphenyl)-2-(6-methyl-3-pyridinyl)acetamide
CID 47259711
N-[(1S)-2-(4-methylphenyl)-1-pyridin-2-ylethyl]-2-(6-methyl-3-pyridinyl)acetamide
CID 96550885
N-(3-chloro-2-methyl-4-pyridinyl)-2-(6-methyl-3-pyridinyl)acetamide
CID 75519852
2,2-dimethyl-3-[[2-(6-methyl-3-pyridinyl)acetyl]amino]propanoic acid
CID 119249860
N-(5-methyl-1,2-oxazol-3-yl)-2-(6-methyl-3-pyridinyl)acetamide
CID 47332378
methyl (2S)-2-[[2-(6-methyl-3-pyridinyl)acetyl]amino]propanoate
CID 47337828
N-[2-(4-aminophenyl)ethyl]-2-(6-methyl-3-pyridinyl)acetamide
CID 119549060
4-methyl-4-[[2-(6-methyl-3-pyridinyl)acetyl]amino]pentanoic acid
CID 119204226
N-[(2S)-3-methyl-3-phenylbutan-2-yl]-2-(6-methyl-3-pyridinyl)acetamide
CID 95294268
6-[[2-(6-methyl-3-pyridinyl)acetyl]amino]hexanoic acid
CID 119220030
2-methyl-2-[[2-(6-methyl-3-pyridinyl)acetyl]amino]pentanoic acid
CID 119192178

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide?
The IUPAC name of 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide (CID 47338470) is 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide.
What is the SMILES notation for 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide?
The canonical SMILES for 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide is Cc1ccc(CC(=O)NNc2ncccn2)cn1.
What is the InChIKey of 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide?
The InChIKey is SVMSPEFDLYKOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O/c1-9-3-4-10(8-15-9)7-11(18)16-17-12-13-5-2-6-14-12/h2-6,8H,7H2,1H3,(H,16,18)(H,13,14,17).
What are the key properties of 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide?
2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide has a molecular weight of 243.27 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-3-pyridinyl)-N'-pyrimidin-2-ylacetohydrazide is sourced from PubChem (CID 47338470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).