2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide

C13H8Cl3N3O2 — CID 23345083

IUPAC2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
SMILESO=C(NC(=O)c1c(Cl)cccc1Cl)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H8Cl3N3O2/c14-7-4-5-10(17-6-7)18-13(21)19-12(20)11-8(15)2-1-3-9(11)16/h1-6H,(H2,17,18,19,20,21)
InChIKeyMXOSQDIFKFIEKO-UHFFFAOYSA-N
MW344.59 g/mol
LogP4.00
Rot. Bonds2

About 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide

2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide (PubChem CID 23345083) has the molecular formula C13H8Cl3N3O2 and a molecular weight of 344.59 g/mol. Its IUPAC name is 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
PubChem CID23345083
Molecular FormulaC13H8Cl3N3O2
Molecular Weight344.59 g/mol
Exact Mass342.97
IUPAC Name2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
SMILESO=C(NC(=O)c1c(Cl)cccc1Cl)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H8Cl3N3O2/c14-7-4-5-10(17-6-7)18-13(21)19-12(20)11-8(15)2-1-3-9(11)16/h1-6H,(H2,17,18,19,20,21)
InChIKeyMXOSQDIFKFIEKO-UHFFFAOYSA-N
XLogP4.00
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.59
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-N-[(5-chloropyrazin-2-yl)carbamoyl]benzamide
CID 21313073
2,6-dichloro-N-[[5-(3,4-dichlorophenyl)sulfanyl-2-pyridinyl]carbamoyl]benzamide
CID 12912898
2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide
CID 134102994
2,6-dichloro-N-[(6-chloroquinoxalin-2-yl)carbamoyl]benzamide
CID 21313128
N-[(5-tert-butylpyrazin-2-yl)carbamoyl]-2,6-dichlorobenzamide
CID 21313103
2,6-dichloro-N-[[5-[3-(trifluoromethyl)phenyl]-2-pyridinyl]carbamoyl]benzamide
CID 13242668
2,6-dichloro-N-[[5-[3-chloro-5-(trifluoromethyl)phenoxy]-2-pyridinyl]carbamoyl]benzamide
CID 56980860
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-[[5-(4-chlorophenoxy)-2-pyridinyl]carbamoyl]-2,6-dimethoxybenzamide
CID 23463895
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
2-chloro-N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide
CID 881777
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide (CID 23345083) is 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide is O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1ccc(Cl)cn1.
What is the InChIKey of 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide?
The InChIKey is MXOSQDIFKFIEKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl3N3O2/c14-7-4-5-10(17-6-7)18-13(21)19-12(20)11-8(15)2-1-3-9(11)16/h1-6H,(H2,17,18,19,20,21).
What are the key properties of 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide?
2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide has a molecular weight of 344.59 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide is sourced from PubChem (CID 23345083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).