2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide

C10H15ClN4O3 — CID 106239358

IUPAC2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide
SMILESCCn1ncc(NCCOCC(N)=O)c(Cl)c1=O
InChIInChI=1S/C10H15ClN4O3/c1-2-15-10(17)9(11)7(5-14-15)13-3-4-18-6-8(12)16/h5,13H,2-4,6H2,1H3,(H2,12,16)
InChIKeyYUDHGFJRBSFXIP-UHFFFAOYSA-N
MW274.71 g/mol
LogP-0.17
Rot. Bonds7

About 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide

2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide (PubChem CID 106239358) has the molecular formula C10H15ClN4O3 and a molecular weight of 274.71 g/mol. Its IUPAC name is 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide
PubChem CID106239358
Molecular FormulaC10H15ClN4O3
Molecular Weight274.71 g/mol
Exact Mass274.08
IUPAC Name2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide
SMILESCCn1ncc(NCCOCC(N)=O)c(Cl)c1=O
InChIInChI=1S/C10H15ClN4O3/c1-2-15-10(17)9(11)7(5-14-15)13-3-4-18-6-8(12)16/h5,13H,2-4,6H2,1H3,(H2,12,16)
InChIKeyYUDHGFJRBSFXIP-UHFFFAOYSA-N
XLogP-0.17
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.71
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]-2,2-dimethylpropanamide
CID 114167431
2-[[5-chloro-1-(2-hydroxyethyl)-6-oxopyridazin-4-yl]amino]ethyl carbamate
CID 114441285
4-chloro-2-ethyl-5-(3-methylbutylamino)pyridazin-3-one
CID 114432236
2-[[5-chloro-1-[2-(dimethylamino)ethyl]-6-oxopyridazin-4-yl]amino]ethyl carbamate
CID 114441286
4-chloro-5-[2-(2-methoxyethoxy)ethylamino]-2-(2-methylpropyl)pyridazin-3-one
CID 114436398
2-[[5-chloro-6-oxo-1-(2,2,2-trifluoroethyl)pyridazin-4-yl]amino]ethyl carbamate
CID 114441267
2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]propanamide
CID 114433471
5-(3-butoxypropylamino)-4-chloro-2-(2-hydroxyethyl)pyridazin-3-one
CID 114442428
4-chloro-2-(2-hydroxyethyl)-5-(3-propoxypropylamino)pyridazin-3-one
CID 114441017
2-[2-[[5-bromo-1-(cyclopropylmethyl)-6-oxopyridazin-4-yl]amino]ethoxy]acetamide
CID 106239365
2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]-N-ethylethanesulfonamide
CID 106338048
4-chloro-2-ethyl-5-(5-methylhexylamino)pyridazin-3-one
CID 114440676

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide (CID 106239358) is 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide is CCn1ncc(NCCOCC(N)=O)c(Cl)c1=O.
What is the InChIKey of 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide?
The InChIKey is YUDHGFJRBSFXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O3/c1-2-15-10(17)9(11)7(5-14-15)13-3-4-18-6-8(12)16/h5,13H,2-4,6H2,1H3,(H2,12,16).
What are the key properties of 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide?
2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide has a molecular weight of 274.71 g/mol, XLogP of -0.17, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5-chloro-1-ethyl-6-oxopyridazin-4-yl)amino]ethoxy]acetamide is sourced from PubChem (CID 106239358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).