N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide

C17H18N4O2 — CID 171446418

IUPACN-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide
SMILESCCC1Cc2cc(NC(=O)c3ccnnc3)cc(C)c2NC1=O
InChIInChI=1S/C17H18N4O2/c1-3-11-7-13-8-14(6-10(2)15(13)21-16(11)22)20-17(23)12-4-5-18-19-9-12/h4-6,8-9,11H,3,7H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyWTMUAXXCUIFFTE-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.56
Rot. Bonds3

About N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide

N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide (PubChem CID 171446418) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide
PubChem CID171446418
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC NameN-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide
SMILESCCC1Cc2cc(NC(=O)c3ccnnc3)cc(C)c2NC1=O
InChIInChI=1S/C17H18N4O2/c1-3-11-7-13-8-14(6-10(2)15(13)21-16(11)22)20-17(23)12-4-5-18-19-9-12/h4-6,8-9,11H,3,7H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyWTMUAXXCUIFFTE-UHFFFAOYSA-N
XLogP2.56
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide?
The IUPAC name of N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide (CID 171446418) is N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide?
The canonical SMILES for N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide is CCC1Cc2cc(NC(=O)c3ccnnc3)cc(C)c2NC1=O.
What is the InChIKey of N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide?
The InChIKey is WTMUAXXCUIFFTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-3-11-7-13-8-14(6-10(2)15(13)21-16(11)22)20-17(23)12-4-5-18-19-9-12/h4-6,8-9,11H,3,7H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide?
N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-8-methyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyridazine-4-carboxamide is sourced from PubChem (CID 171446418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).