6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide

C14H8Cl2N4O — CID 61041185

IUPAC6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c2cccnc12)c1ccc(Cl)nn1
InChIInChI=1S/C14H8Cl2N4O/c15-9-3-4-10(13-8(9)2-1-7-17-13)18-14(21)11-5-6-12(16)20-19-11/h1-7H,(H,18,21)
InChIKeyFPOIAAVDNJBWPQ-UHFFFAOYSA-N
MW319.15 g/mol
LogP3.58
Rot. Bonds2

About 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide

6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide (PubChem CID 61041185) has the molecular formula C14H8Cl2N4O and a molecular weight of 319.15 g/mol. Its IUPAC name is 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide
PubChem CID61041185
Molecular FormulaC14H8Cl2N4O
Molecular Weight319.15 g/mol
Exact Mass318.01
IUPAC Name6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c2cccnc12)c1ccc(Cl)nn1
InChIInChI=1S/C14H8Cl2N4O/c15-9-3-4-10(13-8(9)2-1-7-17-13)18-14(21)11-5-6-12(16)20-19-11/h1-7H,(H,18,21)
InChIKeyFPOIAAVDNJBWPQ-UHFFFAOYSA-N
XLogP3.58
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.15
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(5-chloroquinolin-8-yl)pyridine-4-carboxamide
CID 66464804
N-(5-chloroquinolin-8-yl)-3-hydroxybenzamide
CID 115577672
3-amino-N-(5-chloroquinolin-8-yl)-1H-pyrazole-5-carboxamide
CID 64525415
4,5-dibromo-N-(5-chloroquinolin-8-yl)thiophene-2-carboxamide
CID 78915812
3-chloro-N-(5-chloroquinolin-8-yl)-2,2-dimethylpropanamide
CID 63680758
benzyl N-(5-chloroquinolin-8-yl)carbamate
CID 130156860
1-(5-chloroquinolin-8-yl)-3-cyclopentylurea
CID 47201915
3-amino-N-(5-chloroquinolin-8-yl)-2,2,3-trimethylbutanamide
CID 65269986
3-chloro-N-[(5-chloroquinolin-8-yl)carbamoyl]propanamide
CID 116785166
N-(5-chloroquinolin-8-yl)piperidine-1-carboxamide
CID 116783798
5-amino-N-(5-chloroquinolin-8-yl)-1-methylpyrazole-4-carboxamide
CID 104625471
4-amino-N-(5-chloroquinolin-8-yl)-1-methylpyrazole-3-carboxamide
CID 65355080

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide (CID 61041185) is 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide is O=C(Nc1ccc(Cl)c2cccnc12)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide?
The InChIKey is FPOIAAVDNJBWPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N4O/c15-9-3-4-10(13-8(9)2-1-7-17-13)18-14(21)11-5-6-12(16)20-19-11/h1-7H,(H,18,21).
What are the key properties of 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide?
6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide has a molecular weight of 319.15 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-chloroquinolin-8-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 61041185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).