2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one

C14H20N4O2 — CID 71870932

IUPAC2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
SMILESCn1nc2c(cc1=O)CN(CCN1CCCC1=O)CC2
InChIInChI=1S/C14H20N4O2/c1-16-14(20)9-11-10-17(6-4-12(11)15-16)7-8-18-5-2-3-13(18)19/h9H,2-8,10H2,1H3
InChIKeyFOJWAWKHMRCURX-UHFFFAOYSA-N
MW276.34 g/mol
LogP-0.24
Rot. Bonds3

About 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one

2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one (PubChem CID 71870932) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one.

Molecular Properties

Compound Name2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
PubChem CID71870932
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
SMILESCn1nc2c(cc1=O)CN(CCN1CCCC1=O)CC2
InChIInChI=1S/C14H20N4O2/c1-16-14(20)9-11-10-17(6-4-12(11)15-16)7-8-18-5-2-3-13(18)19/h9H,2-8,10H2,1H3
InChIKeyFOJWAWKHMRCURX-UHFFFAOYSA-N
XLogP-0.24
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 5-0.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one with MolForge

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Related Compounds

2-methyl-6-(3-phenylprop-2-enyl)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 154740584
6-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 111469786
6-[[(1R,6R)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 99832484
6-(2,3-dihydro-1H-indol-7-ylmethyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 120849480
6-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 154738032
6-[2-(2,4-difluorophenyl)-2-hydroxyethyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 111469783
6-(2,3-dihydro-1H-indol-7-ylmethyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one;hydrochloride
CID 120849479
2-(2-methyl-3-oxo-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-N-[(3R)-2-oxoazepan-3-yl]acetamide
CID 95781787
methyl 3-[(2-methyl-3-oxo-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)methyl]thiophene-2-carboxylate
CID 71971937
6-[3-(4-chlorophenoxy)-2-hydroxypropyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 111469782
6-[[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 126791482
6-(4,4-dimethylcyclohexyl)sulfonyl-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 91652726

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The IUPAC name of 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one (CID 71870932) is 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one.
What is the SMILES notation for 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The canonical SMILES for 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one is Cn1nc2c(cc1=O)CN(CCN1CCCC1=O)CC2.
What is the InChIKey of 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
The InChIKey is FOJWAWKHMRCURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-16-14(20)9-11-10-17(6-4-12(11)15-16)7-8-18-5-2-3-13(18)19/h9H,2-8,10H2,1H3.
What are the key properties of 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one?
2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one has a molecular weight of 276.34 g/mol, XLogP of -0.24, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[2-(2-oxopyrrolidin-1-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one is sourced from PubChem (CID 71870932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).