5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide

C9H9N7O — CID 107590045

IUPAC5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide
SMILESNNc1cnc(C(=O)Nc2cncnc2)cn1
InChIInChI=1S/C9H9N7O/c10-16-8-4-13-7(3-14-8)9(17)15-6-1-11-5-12-2-6/h1-5H,10H2,(H,14,16)(H,15,17)
InChIKeyJDAUHQDBPFQDKV-UHFFFAOYSA-N
MW231.22 g/mol
LogP-0.20
Rot. Bonds3

About 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide

5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide (PubChem CID 107590045) has the molecular formula C9H9N7O and a molecular weight of 231.22 g/mol. Its IUPAC name is 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide
PubChem CID107590045
Molecular FormulaC9H9N7O
Molecular Weight231.22 g/mol
Exact Mass231.09
IUPAC Name5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide
SMILESNNc1cnc(C(=O)Nc2cncnc2)cn1
InChIInChI=1S/C9H9N7O/c10-16-8-4-13-7(3-14-8)9(17)15-6-1-11-5-12-2-6/h1-5H,10H2,(H,14,16)(H,15,17)
InChIKeyJDAUHQDBPFQDKV-UHFFFAOYSA-N
XLogP-0.20
TPSA118.71 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.22
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-(4-bromophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377733
5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide
CID 107378182
5-hydrazinyl-N-thiophen-3-ylpyrazine-2-carboxamide
CID 107378459
6-hydrazinyl-N-pyrimidin-5-ylpyridazine-3-carboxamide
CID 107590030
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
5-hydrazinyl-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 107377927
5-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 107377456
5-hydrazinyl-N-(4-methyl-3-pyridinyl)pyrazine-2-carboxamide
CID 107378263
5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide
CID 107377682
N-(4-chloro-3-nitrophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107812143
N-(2,6-dibromo-4-methylphenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377960
5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
CID 107377514

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide (CID 107590045) is 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide is NNc1cnc(C(=O)Nc2cncnc2)cn1.
What is the InChIKey of 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide?
The InChIKey is JDAUHQDBPFQDKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N7O/c10-16-8-4-13-7(3-14-8)9(17)15-6-1-11-5-12-2-6/h1-5H,10H2,(H,14,16)(H,15,17).
What are the key properties of 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide?
5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide has a molecular weight of 231.22 g/mol, XLogP of -0.20, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide is sourced from PubChem (CID 107590045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).