3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide

C11H14FN5O2 — CID 105388397

IUPAC3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide
SMILESNNc1nccc(C(=O)NCC2CCC(=O)N2)c1F
InChIInChI=1S/C11H14FN5O2/c12-9-7(3-4-14-10(9)17-13)11(19)15-5-6-1-2-8(18)16-6/h3-4,6H,1-2,5,13H2,(H,14,17)(H,15,19)(H,16,18)
InChIKeyMDUNRTPFETXFQG-UHFFFAOYSA-N
MW267.26 g/mol
LogP-0.49
Rot. Bonds4

About 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide

3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide (PubChem CID 105388397) has the molecular formula C11H14FN5O2 and a molecular weight of 267.26 g/mol. Its IUPAC name is 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide
PubChem CID105388397
Molecular FormulaC11H14FN5O2
Molecular Weight267.26 g/mol
Exact Mass267.11
IUPAC Name3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide
SMILESNNc1nccc(C(=O)NCC2CCC(=O)N2)c1F
InChIInChI=1S/C11H14FN5O2/c12-9-7(3-4-14-10(9)17-13)11(19)15-5-6-1-2-8(18)16-6/h3-4,6H,1-2,5,13H2,(H,14,17)(H,15,19)(H,16,18)
InChIKeyMDUNRTPFETXFQG-UHFFFAOYSA-N
XLogP-0.49
TPSA109.14 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 5-0.49
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 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide (CID 105388397) is 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide is NNc1nccc(C(=O)NCC2CCC(=O)N2)c1F.
What is the InChIKey of 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide?
The InChIKey is MDUNRTPFETXFQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN5O2/c12-9-7(3-4-14-10(9)17-13)11(19)15-5-6-1-2-8(18)16-6/h3-4,6H,1-2,5,13H2,(H,14,17)(H,15,19)(H,16,18).
What are the key properties of 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide?
3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide has a molecular weight of 267.26 g/mol, XLogP of -0.49, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-hydrazinyl-N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 105388397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).