N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide

C9H13N3O3 — CID 106548842

IUPACN-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide
SMILESCc1cnn(CC(=O)NCCO)c(=O)c1
InChIInChI=1S/C9H13N3O3/c1-7-4-9(15)12(11-5-7)6-8(14)10-2-3-13/h4-5,13H,2-3,6H2,1H3,(H,10,14)
InChIKeyQEYUIFREJUPPRO-UHFFFAOYSA-N
MW211.22 g/mol
LogP-1.34
Rot. Bonds4

About N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide

N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide (PubChem CID 106548842) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide
PubChem CID106548842
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC NameN-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide
SMILESCc1cnn(CC(=O)NCCO)c(=O)c1
InChIInChI=1S/C9H13N3O3/c1-7-4-9(15)12(11-5-7)6-8(14)10-2-3-13/h4-5,13H,2-3,6H2,1H3,(H,10,14)
InChIKeyQEYUIFREJUPPRO-UHFFFAOYSA-N
XLogP-1.34
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-(4-methyl-6-oxopyridazin-1-yl)acetamide
CID 131176187
methyl 2-(4-methyl-6-oxopyridazin-1-yl)acetate
CID 106548424
2-[(4-methyl-6-oxopyridazin-1-yl)methyl]prop-2-enoic acid
CID 106548460
2-(3,5-dimethylpyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 573590
ethyl 2-(4-methyl-6-oxopyridazin-1-yl)acetate
CID 77231410
N-(2-methoxyethyl)-2-[6-oxo-4-(propylamino)pyridazin-1-yl]acetamide
CID 103220247
2-[4-(2-aminoethylamino)-6-oxopyridazin-1-yl]-N-ethylacetamide
CID 103221101
N-ethyl-2-[4-[2-(methylamino)ethylamino]-6-oxopyridazin-1-yl]acetamide
CID 103223616
N-(cyanomethyl)-2-(4-iodo-6-oxopyridazin-1-yl)acetamide
CID 114553441
2-[2-(3,4-dichlorophenyl)-2-oxoethyl]-5-methylpyridazin-3-one
CID 106548770
2-[2-(2,5-dichlorothiophen-3-yl)-2-oxoethyl]-5-methylpyridazin-3-one
CID 106548757
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-butylacetamide
CID 103222761

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide (CID 106548842) is N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide is Cc1cnn(CC(=O)NCCO)c(=O)c1.
What is the InChIKey of N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide?
The InChIKey is QEYUIFREJUPPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-7-4-9(15)12(11-5-7)6-8(14)10-2-3-13/h4-5,13H,2-3,6H2,1H3,(H,10,14).
What are the key properties of N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide?
N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide has a molecular weight of 211.22 g/mol, XLogP of -1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(4-methyl-6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 106548842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).