2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide

C9H9Cl2N3O — CID 166330081

IUPAC2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide
SMILESO=C(CC1CC1)Nc1cc(Cl)nnc1Cl
InChIInChI=1S/C9H9Cl2N3O/c10-7-4-6(9(11)14-13-7)12-8(15)3-5-1-2-5/h4-5H,1-3H2,(H,12,13,15)
InChIKeyGCQXLSPWIKLBTO-UHFFFAOYSA-N
MW246.10 g/mol
LogP2.52
Rot. Bonds3

About 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide

2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide (PubChem CID 166330081) has the molecular formula C9H9Cl2N3O and a molecular weight of 246.10 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide
PubChem CID166330081
Molecular FormulaC9H9Cl2N3O
Molecular Weight246.10 g/mol
Exact Mass245.01
IUPAC Name2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide
SMILESO=C(CC1CC1)Nc1cc(Cl)nnc1Cl
InChIInChI=1S/C9H9Cl2N3O/c10-7-4-6(9(11)14-13-7)12-8(15)3-5-1-2-5/h4-5H,1-3H2,(H,12,13,15)
InChIKeyGCQXLSPWIKLBTO-UHFFFAOYSA-N
XLogP2.52
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.10
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 28776891
N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide
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[4-chloro-2-[(2-cyclopropylacetyl)amino]phenyl]boronic acid
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N-(2-amino-5-chlorophenyl)-2-cycloheptylacetamide
CID 114457006
2-cyclopentyl-N-(2,5-dichlorophenyl)acetamide
CID 7733768
N-(2-amino-4-chlorophenyl)-2-(thian-4-yl)acetamide
CID 83145566
N-(5-bromo-2-chlorophenyl)-2-cyclobutylacetamide
CID 103707266
N-[2-(chloromethyl)phenyl]-2-cyclopropylacetamide
CID 114298279
N-[2-chloro-5-(4-hydroxybut-1-ynyl)phenyl]-2-cyclopropylacetamide
CID 62915790
N-[4-chloro-2-(4-hydroxybut-1-ynyl)phenyl]-2-cyclopropylacetamide
CID 81263564
N-[2-chloro-5-[(E)-N'-hydroxycarbamimidoyl]phenyl]-2-cyclobutylacetamide
CID 103166180
N-(2-chloro-3-pyridinyl)-2-piperidin-4-ylacetamide
CID 54910721

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide?
The IUPAC name of 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide (CID 166330081) is 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide.
What is the SMILES notation for 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide?
The canonical SMILES for 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide is O=C(CC1CC1)Nc1cc(Cl)nnc1Cl.
What is the InChIKey of 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide?
The InChIKey is GCQXLSPWIKLBTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl2N3O/c10-7-4-6(9(11)14-13-7)12-8(15)3-5-1-2-5/h4-5H,1-3H2,(H,12,13,15).
What are the key properties of 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide?
2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide has a molecular weight of 246.10 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3,6-dichloropyridazin-4-yl)acetamide is sourced from PubChem (CID 166330081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).