N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide

C17H21N3O2 — CID 20968276

IUPACN-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESO=C(CN1N=C(c2ccccc2)CCC1=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c21-16(18-14-8-4-5-9-14)12-20-17(22)11-10-15(19-20)13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H,18,21)
InChIKeyAHXBVBPOFDZFLB-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.07
Rot. Bonds4

About N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide

N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (PubChem CID 20968276) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
PubChem CID20968276
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESO=C(CN1N=C(c2ccccc2)CCC1=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c21-16(18-14-8-4-5-9-14)12-20-17(22)11-10-15(19-20)13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H,18,21)
InChIKeyAHXBVBPOFDZFLB-UHFFFAOYSA-N
XLogP2.07
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (CID 20968276) is N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is O=C(CN1N=C(c2ccccc2)CCC1=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The InChIKey is AHXBVBPOFDZFLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c21-16(18-14-8-4-5-9-14)12-20-17(22)11-10-15(19-20)13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H,18,21).
What are the key properties of N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide has a molecular weight of 299.37 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is sourced from PubChem (CID 20968276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).