3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide

C10H14N4O2 — CID 102780140

IUPAC3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C10H14N4O2/c1-6-4-5-11-9(6)10(16)12-7-2-3-8(15)14-13-7/h2-3,6,9,11H,4-5H2,1H3,(H,14,15)(H,12,13,16)
InChIKeyFPRMXTJFKZSMPR-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.29
Rot. Bonds2

About 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide

3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide (PubChem CID 102780140) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide
PubChem CID102780140
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C10H14N4O2/c1-6-4-5-11-9(6)10(16)12-7-2-3-8(15)14-13-7/h2-3,6,9,11H,4-5H2,1H3,(H,14,15)(H,12,13,16)
InChIKeyFPRMXTJFKZSMPR-UHFFFAOYSA-N
XLogP-0.29
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide (CID 102780140) is 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide is CC1CCNC1C(=O)Nc1ccc(=O)[nH]n1.
What is the InChIKey of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is FPRMXTJFKZSMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-6-4-5-11-9(6)10(16)12-7-2-3-8(15)14-13-7/h2-3,6,9,11H,4-5H2,1H3,(H,14,15)(H,12,13,16).
What are the key properties of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide?
3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 102780140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).