N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide

C16H11Cl2NO2 — CID 110476557

IUPACN-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide
SMILESCc1ccc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)oc2c1
InChIInChI=1S/C16H11Cl2NO2/c1-9-2-3-10-5-15(21-14(10)4-9)16(20)19-13-7-11(17)6-12(18)8-13/h2-8H,1H3,(H,19,20)
InChIKeyMDNLZKKCWNBSCX-UHFFFAOYSA-N
MW320.18 g/mol
LogP5.30
Rot. Bonds2

About N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide

N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide (PubChem CID 110476557) has the molecular formula C16H11Cl2NO2 and a molecular weight of 320.18 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide
PubChem CID110476557
Molecular FormulaC16H11Cl2NO2
Molecular Weight320.18 g/mol
Exact Mass319.02
IUPAC NameN-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide
SMILESCc1ccc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)oc2c1
InChIInChI=1S/C16H11Cl2NO2/c1-9-2-3-10-5-15(21-14(10)4-9)16(20)19-13-7-11(17)6-12(18)8-13/h2-8H,1H3,(H,19,20)
InChIKeyMDNLZKKCWNBSCX-UHFFFAOYSA-N
XLogP5.30
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.18
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide
CID 110476452
5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
CID 19240955
N-(3-acetylphenyl)-6-methyl-1-benzofuran-2-carboxamide
CID 84577090
N-[2-(3-chlorophenyl)ethyl]-6-methyl-1-benzofuran-2-carboxamide
CID 112529537
N-(3,5-dichlorophenyl)-7-methyl-1-benzofuran-2-carboxamide
CID 100795319
1-(6-methyl-1-benzofuran-2-yl)ethanone
CID 159473013
N-(1H-imidazol-2-yl)-6-methyl-1-benzofuran-2-carboxamide
CID 112524336
N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-benzofuran-2-carboxamide
CID 3124109
2-methyl-1-(6-methyl-1-benzofuran-2-yl)propan-1-one
CID 165451445
2-bromo-N-(3,5-dichlorophenyl)-5-methylbenzamide
CID 81110211
N-[2-(diethylamino)ethyl]-6-methyl-1-benzofuran-2-carboxamide
CID 84575561
N-[3-[(3-chlorobenzoyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 1136389

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide (CID 110476557) is N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide is Cc1ccc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)oc2c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide?
The InChIKey is MDNLZKKCWNBSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2NO2/c1-9-2-3-10-5-15(21-14(10)4-9)16(20)19-13-7-11(17)6-12(18)8-13/h2-8H,1H3,(H,19,20).
What are the key properties of N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide?
N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide has a molecular weight of 320.18 g/mol, XLogP of 5.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-6-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 110476557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).