2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide

C15H13Cl2NO — CID 159197280

IUPAC2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide
SMILESCc1cccc(CNC(=O)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO/c1-10-4-2-5-11(8-10)9-18-15(19)14-12(16)6-3-7-13(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyNHFGLIITFDSOGD-UHFFFAOYSA-N
MW294.18 g/mol
LogP4.23
Rot. Bonds3

About 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide

2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide (PubChem CID 159197280) has the molecular formula C15H13Cl2NO and a molecular weight of 294.18 g/mol. Its IUPAC name is 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide
PubChem CID159197280
Molecular FormulaC15H13Cl2NO
Molecular Weight294.18 g/mol
Exact Mass293.04
IUPAC Name2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide
SMILESCc1cccc(CNC(=O)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO/c1-10-4-2-5-11(8-10)9-18-15(19)14-12(16)6-3-7-13(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyNHFGLIITFDSOGD-UHFFFAOYSA-N
XLogP4.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.18
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-4-methyl-N-[(3-methylphenyl)methyl]benzamide
CID 99835975
3,4-dichloro-N-[(3-methylphenyl)methyl]benzamide
CID 38295590
4-amino-3,5-dichloro-N-[(3-methylphenyl)methyl]benzamide
CID 82793892
1-[(2-chlorophenyl)methyl]-3-[(3-methylphenyl)methyl]urea
CID 108897773
4-amino-2-chloro-N-[(3-methylphenyl)methyl]benzamide
CID 28748811
3-N-(2-chlorophenyl)-1-N-[(3-methylphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054323
3-amino-2-chloro-N-[(3-methylphenyl)methyl]benzamide
CID 112575105
3,5-dimethyl-N-[(3-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
CID 54944517
5-chloro-N-[(3-methylphenyl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 110850820
2,3-dihydroxy-N-[(3-methylphenyl)methyl]benzamide
CID 114343999
(3-methylphenyl)methylurea
CID 60776531
2-chloro-N-[(3-chlorophenyl)methyl]-6-fluorobenzamide
CID 2679700

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide (CID 159197280) is 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide is Cc1cccc(CNC(=O)c2c(Cl)cccc2Cl)c1.
What is the InChIKey of 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide?
The InChIKey is NHFGLIITFDSOGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO/c1-10-4-2-5-11(8-10)9-18-15(19)14-12(16)6-3-7-13(14)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide?
2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide has a molecular weight of 294.18 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[(3-methylphenyl)methyl]benzamide is sourced from PubChem (CID 159197280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).