5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide

C16H10Cl2N2O2 — CID 17099107

IUPAC5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1cccnc1Cl)c1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C16H10Cl2N2O2/c17-11-4-1-3-10(9-11)13-6-7-14(22-13)16(21)20-12-5-2-8-19-15(12)18/h1-9H,(H,20,21)
InChIKeyHJRIYYZLBOZDKE-UHFFFAOYSA-N
MW333.17 g/mol
LogP4.90
Rot. Bonds3

About 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide

5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide (PubChem CID 17099107) has the molecular formula C16H10Cl2N2O2 and a molecular weight of 333.17 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide
PubChem CID17099107
Molecular FormulaC16H10Cl2N2O2
Molecular Weight333.17 g/mol
Exact Mass332.01
IUPAC Name5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1cccnc1Cl)c1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C16H10Cl2N2O2/c17-11-4-1-3-10(9-11)13-6-7-14(22-13)16(21)20-12-5-2-8-19-15(12)18/h1-9H,(H,20,21)
InChIKeyHJRIYYZLBOZDKE-UHFFFAOYSA-N
XLogP4.90
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.17
LogP ≤ 54.90
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

5-(3-chlorophenyl)-N-(2-methylquinolin-8-yl)furan-2-carboxamide
CID 15991503
5-(3-chlorophenyl)-N-(2,4-dimethylphenyl)furan-2-carboxamide
CID 880542
N-(5-bromo-2-pyridinyl)-5-(3-chlorophenyl)furan-2-carboxamide
CID 2281367
5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
CID 3656622
5-(3-chlorophenyl)-N-(4-methoxyphenyl)furan-2-carboxamide
CID 880701
5-(3-chlorophenyl)-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]furan-2-carboxamide
CID 28670293
N-[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 3989552
N-(2-chloro-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 17253103
2-[3-[[5-(3-chlorophenyl)furan-2-carbonyl]amino]phenyl]acetic acid
CID 59654716
5-(3-chlorophenyl)-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxyphenyl]furan-2-carboxamide
CID 28670300
N-(3-benzamido-4-methylphenyl)-5-(3-chlorophenyl)furan-2-carboxamide
CID 1344294
N-[2-(4-benzoylpiperazin-1-yl)phenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17117874

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide (CID 17099107) is 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide is O=C(Nc1cccnc1Cl)c1ccc(-c2cccc(Cl)c2)o1.
What is the InChIKey of 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide?
The InChIKey is HJRIYYZLBOZDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2O2/c17-11-4-1-3-10(9-11)13-6-7-14(22-13)16(21)20-12-5-2-8-19-15(12)18/h1-9H,(H,20,21).
What are the key properties of 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide?
5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide has a molecular weight of 333.17 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 17099107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).