3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile

C14H10N4O2 — CID 80510072

IUPAC3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile
SMILESN#Cc1ccnnc1Oc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H10N4O2/c15-8-10-5-6-16-18-14(10)20-11-2-3-12-9(7-11)1-4-13(19)17-12/h2-3,5-7H,1,4H2,(H,17,19)
InChIKeyFZCNPWLMJHNLQN-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.03
Rot. Bonds2

About 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile

3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile (PubChem CID 80510072) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile.

Molecular Properties

Compound Name3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile
PubChem CID80510072
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile
SMILESN#Cc1ccnnc1Oc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H10N4O2/c15-8-10-5-6-16-18-14(10)20-11-2-3-12-9(7-11)1-4-13(19)17-12/h2-3,5-7H,1,4H2,(H,17,19)
InChIKeyFZCNPWLMJHNLQN-UHFFFAOYSA-N
XLogP2.03
TPSA87.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile?
The IUPAC name of 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile (CID 80510072) is 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile.
What is the SMILES notation for 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile?
The canonical SMILES for 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile is N#Cc1ccnnc1Oc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile?
The InChIKey is FZCNPWLMJHNLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c15-8-10-5-6-16-18-14(10)20-11-2-3-12-9(7-11)1-4-13(19)17-12/h2-3,5-7H,1,4H2,(H,17,19).
What are the key properties of 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile?
3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile has a molecular weight of 266.26 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridazine-4-carbonitrile is sourced from PubChem (CID 80510072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).