3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide

C15H17ClN4O — CID 62248813

IUPAC3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2nc(NN)ccc2Cl)cc1
InChIInChI=1S/C15H17ClN4O/c1-9-3-5-11(6-4-9)10(2)18-15(21)14-12(16)7-8-13(19-14)20-17/h3-8,10H,17H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyNGSKKEXKBNYXLM-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.82
Rot. Bonds4

About 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide

3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 62248813) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
PubChem CID62248813
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2nc(NN)ccc2Cl)cc1
InChIInChI=1S/C15H17ClN4O/c1-9-3-5-11(6-4-9)10(2)18-15(21)14-12(16)7-8-13(19-14)20-17/h3-8,10H,17H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyNGSKKEXKBNYXLM-UHFFFAOYSA-N
XLogP2.82
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.82
H-Bond Donors ≤ 53
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

N-[1-(3-bromophenyl)ethyl]-3-chloro-6-hydrazinylpyridine-2-carboxamide
CID 62237380
3-chloro-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-6-hydrazinylpyridine-2-carboxamide
CID 62247454
3-chloro-6-hydrazinyl-N-(3-methylpentan-2-yl)pyridine-2-carboxamide
CID 62249778
2-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-4-carboxamide
CID 62248978
3-amino-4-chloro-N-[(1S)-1-(4-methylphenyl)ethyl]benzamide
CID 81355966
2-amino-3-chloro-N-[1-(4-methylphenyl)ethyl]benzamide
CID 115540155
2,4-dichloro-N-[1-(4-methylphenyl)ethyl]benzamide
CID 43915384
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62237587
3-chloro-N-[1-(2-chlorophenyl)ethyl]-6-(methylamino)pyridine-2-carboxamide
CID 62175178
3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62235808
2-chloro-N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 60737127
3-chloro-6-hydrazinyl-N-(2-methylsulfanylethyl)pyridine-2-carboxamide
CID 63963599

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide (CID 62248813) is 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide is Cc1ccc(C(C)NC(=O)c2nc(NN)ccc2Cl)cc1.
What is the InChIKey of 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is NGSKKEXKBNYXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-9-3-5-11(6-4-9)10(2)18-15(21)14-12(16)7-8-13(19-14)20-17/h3-8,10H,17H2,1-2H3,(H,18,21)(H,19,20).
What are the key properties of 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide?
3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.82, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 62248813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).