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

C15H17ClN4O — CID 62249151

IUPAC5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1ccccc1CN(C)C(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C15H17ClN4O/c1-10-5-3-4-6-11(10)9-20(2)15(21)12-7-13(16)14(19-17)18-8-12/h3-8H,9,17H2,1-2H3,(H,18,19)
InChIKeyXPNABAKXVCMTEQ-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.60
Rot. Bonds4

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

5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 62249151) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
PubChem CID62249151
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1ccccc1CN(C)C(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C15H17ClN4O/c1-10-5-3-4-6-11(10)9-20(2)15(21)12-7-13(16)14(19-17)18-8-12/h3-8H,9,17H2,1-2H3,(H,18,19)
InChIKeyXPNABAKXVCMTEQ-UHFFFAOYSA-N
XLogP2.60
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

6-chloro-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 60631168
5-chloro-6-hydrazinyl-N-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 62243030
5,6-dichloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60628265
5-chloro-N-(cyclobutylmethyl)-6-hydrazinyl-N-methylpyridine-3-carboxamide
CID 62854972
5-chloro-N-(2-ethoxyethyl)-6-hydrazinyl-N-methylpyridine-3-carboxamide
CID 81073870
5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
CID 63862804
5-chloro-N-[(3-chlorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-3-carboxamide
CID 62179255
3,5-dichloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridin-2-amine
CID 102761719
2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 62175582
N-[(2-chlorophenyl)methyl]-5-hydrazinyl-N-methylpyridine-2-carboxamide
CID 104642594
5-chloro-N-methyl-6-(methylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 62169928
5-chloro-6-hydrazinyl-N-methyl-N-(3-methylbutan-2-yl)pyridine-3-carboxamide
CID 62243427

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide (CID 62249151) is 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide is Cc1ccccc1CN(C)C(=O)c1cnc(NN)c(Cl)c1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is XPNABAKXVCMTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-10-5-3-4-6-11(10)9-20(2)15(21)12-7-13(16)14(19-17)18-8-12/h3-8H,9,17H2,1-2H3,(H,18,19).
What are the key properties of 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 62249151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).