2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide

C11H7Cl2N3O — CID 103892911

IUPAC2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ncccc1Cl)c1cccnc1Cl
InChIInChI=1S/C11H7Cl2N3O/c12-8-4-2-6-15-10(8)16-11(17)7-3-1-5-14-9(7)13/h1-6H,(H,15,16,17)
InChIKeyBGEUHRDQPUPPRY-UHFFFAOYSA-N
MW268.10 g/mol
LogP3.04
Rot. Bonds2

About 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide

2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 103892911) has the molecular formula C11H7Cl2N3O and a molecular weight of 268.10 g/mol. Its IUPAC name is 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
PubChem CID103892911
Molecular FormulaC11H7Cl2N3O
Molecular Weight268.10 g/mol
Exact Mass267.00
IUPAC Name2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1ncccc1Cl)c1cccnc1Cl
InChIInChI=1S/C11H7Cl2N3O/c12-8-4-2-6-15-10(8)16-11(17)7-3-1-5-14-9(7)13/h1-6H,(H,15,16,17)
InChIKeyBGEUHRDQPUPPRY-UHFFFAOYSA-N
XLogP3.04
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.10
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[(2-chloropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 114036719
N-(3-chloro-2-pyridinyl)-2-fluoro-3-methylbenzamide
CID 103943460
2,5-dichloro-N-(3-chloro-2-pyridinyl)pyridine-4-carboxamide
CID 102610397
3-bromo-N-(3-chloro-2-pyridinyl)-2-fluorobenzamide
CID 106547626
N-(3-chloro-2-pyridinyl)-2-nitrobenzamide
CID 113347276
N-(3-chloro-2-pyridinyl)-2-iodo-3-methylbenzamide
CID 103943532
N-(3-chloro-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-5-carboxamide
CID 103893036
N-(3-chloro-2-pyridinyl)-2-(ethylamino)benzamide
CID 103094805
2-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 4245221
N-(3-chloro-2-pyridinyl)-2,4-dimethylbenzamide
CID 103892998
5-acetamido-2-chloro-N-(3-chloro-2-pyridinyl)benzamide
CID 86783432
2-amino-N-(3-chloro-2-pyridinyl)-3-methoxybenzamide
CID 103093876

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide (CID 103892911) is 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide is O=C(Nc1ncccc1Cl)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is BGEUHRDQPUPPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2N3O/c12-8-4-2-6-15-10(8)16-11(17)7-3-1-5-14-9(7)13/h1-6H,(H,15,16,17).
What are the key properties of 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide?
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 268.10 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 103892911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).