2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide

C19H19N5O2 — CID 38853339

IUPAC2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C19H19N5O2/c25-17-12-21-24(16-6-2-1-5-15(16)17)13-19(26)22-14-7-8-18(20-11-14)23-9-3-4-10-23/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,22,26)
InChIKeyOWDNBJXRWDZBBC-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.03
Rot. Bonds4

About 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide

2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide (PubChem CID 38853339) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
PubChem CID38853339
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C19H19N5O2/c25-17-12-21-24(16-6-2-1-5-15(16)17)13-19(26)22-14-7-8-18(20-11-14)23-9-3-4-10-23/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,22,26)
InChIKeyOWDNBJXRWDZBBC-UHFFFAOYSA-N
XLogP2.03
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide?
The IUPAC name of 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide (CID 38853339) is 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide is O=C(Cn1ncc(=O)c2ccccc21)Nc1ccc(N2CCCC2)nc1.
What is the InChIKey of 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide?
The InChIKey is OWDNBJXRWDZBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c25-17-12-21-24(16-6-2-1-5-15(16)17)13-19(26)22-14-7-8-18(20-11-14)23-9-3-4-10-23/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,22,26).
What are the key properties of 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide?
2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide has a molecular weight of 349.39 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 38853339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).