4,6-dichloroquinoline-3-carboxamide

C10H6Cl2N2O — CID 19827987

IUPAC4,6-dichloroquinoline-3-carboxamide
SMILESNC(=O)c1cnc2ccc(Cl)cc2c1Cl
InChIInChI=1S/C10H6Cl2N2O/c11-5-1-2-8-6(3-5)9(12)7(4-14-8)10(13)15/h1-4H,(H2,13,15)
InChIKeyFNCGYQAQWNLMHU-UHFFFAOYSA-N
MW241.08 g/mol
LogP2.64
Rot. Bonds1

About 4,6-dichloroquinoline-3-carboxamide

4,6-dichloroquinoline-3-carboxamide (PubChem CID 19827987) has the molecular formula C10H6Cl2N2O and a molecular weight of 241.08 g/mol. Its IUPAC name is 4,6-dichloroquinoline-3-carboxamide.

Molecular Properties

Compound Name4,6-dichloroquinoline-3-carboxamide
PubChem CID19827987
Molecular FormulaC10H6Cl2N2O
Molecular Weight241.08 g/mol
Exact Mass239.99
IUPAC Name4,6-dichloroquinoline-3-carboxamide
SMILESNC(=O)c1cnc2ccc(Cl)cc2c1Cl
InChIInChI=1S/C10H6Cl2N2O/c11-5-1-2-8-6(3-5)9(12)7(4-14-8)10(13)15/h1-4H,(H2,13,15)
InChIKeyFNCGYQAQWNLMHU-UHFFFAOYSA-N
XLogP2.64
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.08
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloroquinoline-3-carboxamide?
The IUPAC name of 4,6-dichloroquinoline-3-carboxamide (CID 19827987) is 4,6-dichloroquinoline-3-carboxamide.
What is the SMILES notation for 4,6-dichloroquinoline-3-carboxamide?
The canonical SMILES for 4,6-dichloroquinoline-3-carboxamide is NC(=O)c1cnc2ccc(Cl)cc2c1Cl.
What is the InChIKey of 4,6-dichloroquinoline-3-carboxamide?
The InChIKey is FNCGYQAQWNLMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O/c11-5-1-2-8-6(3-5)9(12)7(4-14-8)10(13)15/h1-4H,(H2,13,15).
What are the key properties of 4,6-dichloroquinoline-3-carboxamide?
4,6-dichloroquinoline-3-carboxamide has a molecular weight of 241.08 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloroquinoline-3-carboxamide is sourced from PubChem (CID 19827987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).