2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide

C14H11Cl3N2O — CID 58990268

IUPAC2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1cnc(CNC(=O)c2c(Cl)cccc2Cl)c(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c1-8-5-11(17)12(18-6-8)7-19-14(20)13-9(15)3-2-4-10(13)16/h2-6H,7H2,1H3,(H,19,20)
InChIKeyFPMSVOUBXDHVMI-UHFFFAOYSA-N
MW329.61 g/mol
LogP4.28
Rot. Bonds3

About 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide

2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide (PubChem CID 58990268) has the molecular formula C14H11Cl3N2O and a molecular weight of 329.61 g/mol. Its IUPAC name is 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide
PubChem CID58990268
Molecular FormulaC14H11Cl3N2O
Molecular Weight329.61 g/mol
Exact Mass327.99
IUPAC Name2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1cnc(CNC(=O)c2c(Cl)cccc2Cl)c(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c1-8-5-11(17)12(18-6-8)7-19-14(20)13-9(15)3-2-4-10(13)16/h2-6H,7H2,1H3,(H,19,20)
InChIKeyFPMSVOUBXDHVMI-UHFFFAOYSA-N
XLogP4.28
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.61
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide
CID 159197280
2,4-dichloro-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]pyridine-3-carboxamide
CID 22027356
2,4-dichloro-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-6-methylpyridine-3-carboxamide
CID 22027361
2,6-dichloro-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]benzamide
CID 8875106
2,6-dichloro-N-(3-chloropropyl)benzamide
CID 3367173
5-chloro-3-methyl-N-[(5-methylpyrimidin-2-yl)methyl]-1-phenylpyrazole-4-carboxamide
CID 155964290
2,6-dichloro-N-[(4-fluorophenyl)methyl]benzamide
CID 841148
3-chloro-N-(2-chloro-6-hydroxyphenyl)-5-methylpyridine-2-carboxamide
CID 141376786
N-but-2-ynyl-2,6-dichlorobenzamide
CID 143542112
2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide
CID 71150032
2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296
2,6-dichloro-N-(4,6-dimethyl-2-pyridinyl)benzamide
CID 5099860

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide (CID 58990268) is 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide is Cc1cnc(CNC(=O)c2c(Cl)cccc2Cl)c(Cl)c1.
What is the InChIKey of 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide?
The InChIKey is FPMSVOUBXDHVMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl3N2O/c1-8-5-11(17)12(18-6-8)7-19-14(20)13-9(15)3-2-4-10(13)16/h2-6H,7H2,1H3,(H,19,20).
What are the key properties of 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide?
2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide has a molecular weight of 329.61 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[(3-chloro-5-methyl-2-pyridinyl)methyl]benzamide is sourced from PubChem (CID 58990268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).