5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide

C8H13N5O — CID 107377682

IUPAC5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide
SMILESCC(C)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C8H13N5O/c1-5(2)12-8(14)6-3-11-7(13-9)4-10-6/h3-5H,9H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyWHTCIVGJBYCLFA-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.10
Rot. Bonds3

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

5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide (PubChem CID 107377682) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide
PubChem CID107377682
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide
SMILESCC(C)NC(=O)c1cnc(NN)cn1
InChIInChI=1S/C8H13N5O/c1-5(2)12-8(14)6-3-11-7(13-9)4-10-6/h3-5H,9H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyWHTCIVGJBYCLFA-UHFFFAOYSA-N
XLogP-0.10
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.10
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-propan-2-ylpyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide (CID 107377682) is 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide is CC(C)NC(=O)c1cnc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide?
The InChIKey is WHTCIVGJBYCLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c1-5(2)12-8(14)6-3-11-7(13-9)4-10-6/h3-5H,9H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide?
5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide has a molecular weight of 195.23 g/mol, XLogP of -0.10, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-propan-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 107377682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).