N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide

C10H14N4O2 — CID 154662241

IUPACN-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide
SMILESCn1nc(NC(=O)N2CCCC2)ccc1=O
InChIInChI=1S/C10H14N4O2/c1-13-9(15)5-4-8(12-13)11-10(16)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3,(H,11,12,16)
InChIKeyDGZOEHQEARDGHB-UHFFFAOYSA-N
MW222.25 g/mol
LogP0.41
Rot. Bonds1

About N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide

N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide (PubChem CID 154662241) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide
PubChem CID154662241
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide
SMILESCn1nc(NC(=O)N2CCCC2)ccc1=O
InChIInChI=1S/C10H14N4O2/c1-13-9(15)5-4-8(12-13)11-10(16)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3,(H,11,12,16)
InChIKeyDGZOEHQEARDGHB-UHFFFAOYSA-N
XLogP0.41
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide (CID 154662241) is N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide is Cn1nc(NC(=O)N2CCCC2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is DGZOEHQEARDGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-13-9(15)5-4-8(12-13)11-10(16)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3,(H,11,12,16).
What are the key properties of N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide?
N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 222.25 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopyridazin-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 154662241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).