5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide

C11H15N7O2 — CID 107377908

IUPAC5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide
SMILESCOCCn1cc(NC(=O)c2cnc(NN)cn2)cn1
InChIInChI=1S/C11H15N7O2/c1-20-3-2-18-7-8(4-15-18)16-11(19)9-5-14-10(17-12)6-13-9/h4-7H,2-3,12H2,1H3,(H,14,17)(H,16,19)
InChIKeyUFUPAVYVIHJWEF-UHFFFAOYSA-N
MW277.29 g/mol
LogP-0.14
Rot. Bonds6

About 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide

5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide (PubChem CID 107377908) has the molecular formula C11H15N7O2 and a molecular weight of 277.29 g/mol. Its IUPAC name is 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide
PubChem CID107377908
Molecular FormulaC11H15N7O2
Molecular Weight277.29 g/mol
Exact Mass277.13
IUPAC Name5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide
SMILESCOCCn1cc(NC(=O)c2cnc(NN)cn2)cn1
InChIInChI=1S/C11H15N7O2/c1-20-3-2-18-7-8(4-15-18)16-11(19)9-5-14-10(17-12)6-13-9/h4-7H,2-3,12H2,1H3,(H,14,17)(H,16,19)
InChIKeyUFUPAVYVIHJWEF-UHFFFAOYSA-N
XLogP-0.14
TPSA119.98 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide (CID 107377908) is 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide is COCCn1cc(NC(=O)c2cnc(NN)cn2)cn1.
What is the InChIKey of 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide?
The InChIKey is UFUPAVYVIHJWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O2/c1-20-3-2-18-7-8(4-15-18)16-11(19)9-5-14-10(17-12)6-13-9/h4-7H,2-3,12H2,1H3,(H,14,17)(H,16,19).
What are the key properties of 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide?
5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide has a molecular weight of 277.29 g/mol, XLogP of -0.14, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 107377908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).