N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide

C11H15N3O2 — CID 122277955

IUPACN-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCn1nc(C2CC2)ccc1=O
InChIInChI=1S/C11H15N3O2/c1-8(15)12-6-7-14-11(16)5-4-10(13-14)9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,12,15)
InChIKeyYXICQPVJZPGHPT-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.26
Rot. Bonds4

About N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide

N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide (PubChem CID 122277955) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide
PubChem CID122277955
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCn1nc(C2CC2)ccc1=O
InChIInChI=1S/C11H15N3O2/c1-8(15)12-6-7-14-11(16)5-4-10(13-14)9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,12,15)
InChIKeyYXICQPVJZPGHPT-UHFFFAOYSA-N
XLogP0.26
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]butanamide
CID 122277843
1-cyclopentyl-3-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]urea
CID 122278186
methyl 4-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethylcarbamoyl]benzoate
CID 122277941
1-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-3-phenylurea
CID 122246350
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-4-fluorobenzamide
CID 122277818
1-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-3-(2-phenylethyl)urea
CID 122278182
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-1-methylpiperidine-3-carboxamide
CID 122277953
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-2-methyl-1,3-thiazole-4-carboxamide
CID 122277924
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-3-phenylpropanamide
CID 122277842
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 122278048
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-2-pyrimidin-2-ylsulfanylacetamide
CID 122278018
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-2-(4-phenylphenyl)acetamide
CID 122277796

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide (CID 122277955) is N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide is CC(=O)NCCn1nc(C2CC2)ccc1=O.
What is the InChIKey of N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide?
The InChIKey is YXICQPVJZPGHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-8(15)12-6-7-14-11(16)5-4-10(13-14)9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,12,15).
What are the key properties of N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide?
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]acetamide is sourced from PubChem (CID 122277955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).