3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide

C12H13ClN4O2 — CID 62522719

IUPAC3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1ccc(CNC(=O)c2nc(NN)ccc2Cl)o1
InChIInChI=1S/C12H13ClN4O2/c1-7-2-3-8(19-7)6-15-12(18)11-9(13)4-5-10(16-11)17-14/h2-5H,6,14H2,1H3,(H,15,18)(H,16,17)
InChIKeyNWSULPROCOKGLF-UHFFFAOYSA-N
MW280.71 g/mol
LogP1.85
Rot. Bonds4

About 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide

3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide (PubChem CID 62522719) has the molecular formula C12H13ClN4O2 and a molecular weight of 280.71 g/mol. Its IUPAC name is 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
PubChem CID62522719
Molecular FormulaC12H13ClN4O2
Molecular Weight280.71 g/mol
Exact Mass280.07
IUPAC Name3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1ccc(CNC(=O)c2nc(NN)ccc2Cl)o1
InChIInChI=1S/C12H13ClN4O2/c1-7-2-3-8(19-7)6-15-12(18)11-9(13)4-5-10(16-11)17-14/h2-5H,6,14H2,1H3,(H,15,18)(H,16,17)
InChIKeyNWSULPROCOKGLF-UHFFFAOYSA-N
XLogP1.85
TPSA93.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.71
LogP ≤ 51.85
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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Related Compounds

3,4-dichloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731633
2-chloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731650
3-chloro-6-hydrazinyl-N-[(6-methyl-3-pyridinyl)methyl]pyridine-2-carboxamide
CID 62989223
3-chloro-6-hydrazinyl-N-(2-methylsulfanylethyl)pyridine-2-carboxamide
CID 63963599
3-chloro-N-[(3-chlorophenyl)methyl]-6-hydrazinylpyridine-2-carboxamide
CID 62532452
3-chloro-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62235822
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62237587
2-hydrazinyl-5-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 62523072
3-chloro-6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-2-carboxamide
CID 64524391
4-N-[(5-methylfuran-2-yl)methyl]-1,3-thiazole-2,4-dicarboxamide
CID 53158295
4-chloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731652
5-amino-2-chloro-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
CID 114045976

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide (CID 62522719) is 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide is Cc1ccc(CNC(=O)c2nc(NN)ccc2Cl)o1.
What is the InChIKey of 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The InChIKey is NWSULPROCOKGLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4O2/c1-7-2-3-8(19-7)6-15-12(18)11-9(13)4-5-10(16-11)17-14/h2-5H,6,14H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide has a molecular weight of 280.71 g/mol, XLogP of 1.85, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-hydrazinyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 62522719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).