4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide

C13H13N5O3 — CID 62247149

IUPAC4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide
SMILESCc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(NN)ccn1
InChIInChI=1S/C13H13N5O3/c1-8-6-10(18(20)21)2-3-11(8)16-13(19)12-7-9(17-14)4-5-15-12/h2-7H,14H2,1H3,(H,15,17)(H,16,19)
InChIKeyXARYNANWXMRVPR-UHFFFAOYSA-N
MW287.28 g/mol
LogP1.84
Rot. Bonds4

About 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide

4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide (PubChem CID 62247149) has the molecular formula C13H13N5O3 and a molecular weight of 287.28 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide
PubChem CID62247149
Molecular FormulaC13H13N5O3
Molecular Weight287.28 g/mol
Exact Mass287.10
IUPAC Name4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide
SMILESCc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(NN)ccn1
InChIInChI=1S/C13H13N5O3/c1-8-6-10(18(20)21)2-3-11(8)16-13(19)12-7-9(17-14)4-5-15-12/h2-7H,14H2,1H3,(H,15,17)(H,16,19)
InChIKeyXARYNANWXMRVPR-UHFFFAOYSA-N
XLogP1.84
TPSA123.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.28
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydrazinyl-N-(4-methyl-3-nitrophenyl)pyridine-2-carboxamide
CID 62238018
4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63671568
4-hydrazinyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 63328534
2-(1-aminoethyl)-N-(2-methyl-4-nitrophenyl)-1,3-thiazole-4-carboxamide
CID 66390995
[2-(2-methyl-4-nitroanilino)-2-oxoethyl] 4-chloropyridine-2-carboxylate
CID 8804293
4-hydrazinyl-N-methyl-N-(4-nitrophenyl)pyridine-2-carboxamide
CID 62243091
2-amino-5-chloro-N-(2-methyl-4-nitrophenyl)pyridine-4-carboxamide
CID 114922911
N-(2-fluoro-5-methylphenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62242371
N-(2-bromo-4-nitrophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 107810328
N-(4-chloro-2-methoxy-5-methylphenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62238327
3-chloro-4-methyl-N-(2-methyl-4-nitrophenyl)benzamide
CID 2913893
4-hydrazinyl-N-methylpyridine-2-carboxamide
CID 43517715

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide (CID 62247149) is 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide is Cc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(NN)ccn1.
What is the InChIKey of 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide?
The InChIKey is XARYNANWXMRVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O3/c1-8-6-10(18(20)21)2-3-11(8)16-13(19)12-7-9(17-14)4-5-15-12/h2-7H,14H2,1H3,(H,15,17)(H,16,19).
What are the key properties of 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide?
4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide has a molecular weight of 287.28 g/mol, XLogP of 1.84, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-methyl-4-nitrophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62247149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).