4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide

C11H17N5O2 — CID 62236139

IUPAC4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide
SMILESCC(C)NC(=O)CNC(=O)c1cc(NN)ccn1
InChIInChI=1S/C11H17N5O2/c1-7(2)15-10(17)6-14-11(18)9-5-8(16-12)3-4-13-9/h3-5,7H,6,12H2,1-2H3,(H,13,16)(H,14,18)(H,15,17)
InChIKeyZFKBCFZQLCFCMN-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.38
Rot. Bonds5

About 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide

4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide (PubChem CID 62236139) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide
PubChem CID62236139
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide
SMILESCC(C)NC(=O)CNC(=O)c1cc(NN)ccn1
InChIInChI=1S/C11H17N5O2/c1-7(2)15-10(17)6-14-11(18)9-5-8(16-12)3-4-13-9/h3-5,7H,6,12H2,1-2H3,(H,13,16)(H,14,18)(H,15,17)
InChIKeyZFKBCFZQLCFCMN-UHFFFAOYSA-N
XLogP-0.38
TPSA109.14 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.38
H-Bond Donors ≤ 54
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 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide (CID 62236139) is 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide is CC(C)NC(=O)CNC(=O)c1cc(NN)ccn1.
What is the InChIKey of 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide?
The InChIKey is ZFKBCFZQLCFCMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-7(2)15-10(17)6-14-11(18)9-5-8(16-12)3-4-13-9/h3-5,7H,6,12H2,1-2H3,(H,13,16)(H,14,18)(H,15,17).
What are the key properties of 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide?
4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.38, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 62236139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).