3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide

C14H12Cl2N2O2 — CID 17440573

IUPAC3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ncccc2C)cc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c1-8-4-3-5-17-13(8)18-14(19)9-6-10(15)12(20-2)11(16)7-9/h3-7H,1-2H3,(H,17,18,19)
InChIKeyFHDJGDBDDFLMOB-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.96
Rot. Bonds3

About 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide

3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide (PubChem CID 17440573) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide
PubChem CID17440573
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC Name3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ncccc2C)cc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c1-8-4-3-5-17-13(8)18-14(19)9-6-10(15)12(20-2)11(16)7-9/h3-7H,1-2H3,(H,17,18,19)
InChIKeyFHDJGDBDDFLMOB-UHFFFAOYSA-N
XLogP3.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3,5-dichloro-N-(3-methyl-2-pyridinyl)benzamide
CID 82786177
4-butoxy-3-chloro-5-ethoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 35031623
4-amino-3-chloro-N-(3-methyl-2-pyridinyl)-5-nitrobenzamide
CID 62152357
1-(3,5-dichloro-4-methoxybenzoyl)-N-(3-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 55958705
4-ethoxy-3-methoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 25344175
3-chloro-4,5-dimethoxy-N-quinolin-5-ylbenzamide
CID 17396837
4-(2-amino-2-oxoethoxy)-3-chloro-N-(3-hydroxy-2-pyridinyl)-5-methoxybenzamide
CID 29476148
2,4-dichloro-N-(3-methyl-2-pyridinyl)benzamide
CID 836075
3,5-dichloro-N-(3-chloro-4-methylphenyl)-4-methoxybenzamide
CID 672349
2-N,6-N-bis(3-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 4216500
4-(methylamino)-N-(3-methyl-2-pyridinyl)benzamide
CID 55042397
2,4-dimethoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 5163949

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide (CID 17440573) is 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide is COc1c(Cl)cc(C(=O)Nc2ncccc2C)cc1Cl.
What is the InChIKey of 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide?
The InChIKey is FHDJGDBDDFLMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-8-4-3-5-17-13(8)18-14(19)9-6-10(15)12(20-2)11(16)7-9/h3-7H,1-2H3,(H,17,18,19).
What are the key properties of 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide?
3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide has a molecular weight of 311.17 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 17440573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).