6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide

C15H13Cl3N4O — CID 60560763

IUPAC6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(NC2CC2)nc1
InChIInChI=1S/C15H13Cl3N4O/c16-9-5-11(17)14(12(18)6-9)21-22-15(23)8-1-4-13(19-7-8)20-10-2-3-10/h1,4-7,10,21H,2-3H2,(H,19,20)(H,22,23)
InChIKeyZTDHAQUGKPWPJO-UHFFFAOYSA-N
MW371.66 g/mol
LogP4.37
Rot. Bonds5

About 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide

6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide (PubChem CID 60560763) has the molecular formula C15H13Cl3N4O and a molecular weight of 371.66 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
PubChem CID60560763
Molecular FormulaC15H13Cl3N4O
Molecular Weight371.66 g/mol
Exact Mass370.02
IUPAC Name6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(NC2CC2)nc1
InChIInChI=1S/C15H13Cl3N4O/c16-9-5-11(17)14(12(18)6-9)21-22-15(23)8-1-4-13(19-7-8)20-10-2-3-10/h1,4-7,10,21H,2-3H2,(H,19,20)(H,22,23)
InChIKeyZTDHAQUGKPWPJO-UHFFFAOYSA-N
XLogP4.37
TPSA66.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.66
LogP ≤ 54.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The IUPAC name of 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide (CID 60560763) is 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The canonical SMILES for 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide is O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(NC2CC2)nc1.
What is the InChIKey of 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The InChIKey is ZTDHAQUGKPWPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl3N4O/c16-9-5-11(17)14(12(18)6-9)21-22-15(23)8-1-4-13(19-7-8)20-10-2-3-10/h1,4-7,10,21H,2-3H2,(H,19,20)(H,22,23).
What are the key properties of 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide has a molecular weight of 371.66 g/mol, XLogP of 4.37, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 60560763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).