5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide

C11H19N5O — CID 107377765

IUPAC5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide
SMILESCCC(C)C(C)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C11H19N5O/c1-4-7(2)8(3)15-11(17)9-5-14-10(16-12)6-13-9/h5-8H,4,12H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyGSORUAJFCXGCES-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.93
Rot. Bonds5

About 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide

5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide (PubChem CID 107377765) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide
PubChem CID107377765
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide
SMILESCCC(C)C(C)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C11H19N5O/c1-4-7(2)8(3)15-11(17)9-5-14-10(16-12)6-13-9/h5-8H,4,12H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyGSORUAJFCXGCES-UHFFFAOYSA-N
XLogP0.93
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide (CID 107377765) is 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide is CCC(C)C(C)NC(=O)c1cnc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide?
The InChIKey is GSORUAJFCXGCES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-4-7(2)8(3)15-11(17)9-5-14-10(16-12)6-13-9/h5-8H,4,12H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide?
5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide has a molecular weight of 237.31 g/mol, XLogP of 0.93, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(3-methylpentan-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 107377765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).