3,5-dichloropyridine-4-carboxamide

C6H4Cl2N2O — CID 2802911

IUPAC3,5-dichloropyridine-4-carboxamide
SMILESNC(=O)c1c(Cl)cncc1Cl
InChIInChI=1S/C6H4Cl2N2O/c7-3-1-10-2-4(8)5(3)6(9)11/h1-2H,(H2,9,11)
InChIKeyMGQHSBXCQUJESR-UHFFFAOYSA-N
MW191.02 g/mol
LogP1.49
Rot. Bonds1

About 3,5-dichloropyridine-4-carboxamide

3,5-dichloropyridine-4-carboxamide (PubChem CID 2802911) has the molecular formula C6H4Cl2N2O and a molecular weight of 191.02 g/mol. Its IUPAC name is 3,5-dichloropyridine-4-carboxamide.

Molecular Properties

Compound Name3,5-dichloropyridine-4-carboxamide
PubChem CID2802911
Molecular FormulaC6H4Cl2N2O
Molecular Weight191.02 g/mol
Exact Mass189.97
IUPAC Name3,5-dichloropyridine-4-carboxamide
SMILESNC(=O)c1c(Cl)cncc1Cl
InChIInChI=1S/C6H4Cl2N2O/c7-3-1-10-2-4(8)5(3)6(9)11/h1-2H,(H2,9,11)
InChIKeyMGQHSBXCQUJESR-UHFFFAOYSA-N
XLogP1.49
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.02
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloropyridine-4-carboxamide?
The IUPAC name of 3,5-dichloropyridine-4-carboxamide (CID 2802911) is 3,5-dichloropyridine-4-carboxamide.
What is the SMILES notation for 3,5-dichloropyridine-4-carboxamide?
The canonical SMILES for 3,5-dichloropyridine-4-carboxamide is NC(=O)c1c(Cl)cncc1Cl.
What is the InChIKey of 3,5-dichloropyridine-4-carboxamide?
The InChIKey is MGQHSBXCQUJESR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2N2O/c7-3-1-10-2-4(8)5(3)6(9)11/h1-2H,(H2,9,11).
What are the key properties of 3,5-dichloropyridine-4-carboxamide?
3,5-dichloropyridine-4-carboxamide has a molecular weight of 191.02 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloropyridine-4-carboxamide is sourced from PubChem (CID 2802911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).