N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide

C20H13Cl2NO2 — CID 7899905

IUPACN-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
SMILESCc1c(C(=O)Nc2cc(Cl)ccc2Cl)oc2c1ccc1ccccc12
InChIInChI=1S/C20H13Cl2NO2/c1-11-14-8-6-12-4-2-3-5-15(12)19(14)25-18(11)20(24)23-17-10-13(21)7-9-16(17)22/h2-10H,1H3,(H,23,24)
InChIKeyRZWLVHBUYHJDPZ-UHFFFAOYSA-N
MW370.24 g/mol
LogP6.45
Rot. Bonds2

About N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide

N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide (PubChem CID 7899905) has the molecular formula C20H13Cl2NO2 and a molecular weight of 370.24 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
PubChem CID7899905
Molecular FormulaC20H13Cl2NO2
Molecular Weight370.24 g/mol
Exact Mass369.03
IUPAC NameN-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
SMILESCc1c(C(=O)Nc2cc(Cl)ccc2Cl)oc2c1ccc1ccccc12
InChIInChI=1S/C20H13Cl2NO2/c1-11-14-8-6-12-4-2-3-5-15(12)19(14)25-18(11)20(24)23-17-10-13(21)7-9-16(17)22/h2-10H,1H3,(H,23,24)
InChIKeyRZWLVHBUYHJDPZ-UHFFFAOYSA-N
XLogP6.45
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.24
LogP ≤ 56.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7946958
N-(3-chloro-2,6-diethylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7920539
N-(2-bromo-4-methylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7929835
N-(4-fluorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7733139
3-methyl-N-(1,3,4-thiadiazol-2-yl)benzo[g][1]benzofuran-2-carboxamide
CID 30550761
N-(2,5-dichlorophenyl)-3-oxobenzo[f]chromene-2-carboxamide
CID 3692477
N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 30831158
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7534992
3-methyl-N-[(1R)-1-phenylethyl]benzo[g][1]benzofuran-2-carboxamide
CID 7945436
3-methyl-N-(3-methylbutyl)benzo[g][1]benzofuran-2-carboxamide
CID 7926460
3-methyl-N-[3-(methylamino)propyl]benzo[g][1]benzofuran-2-carboxamide
CID 119430725
7-chloro-N-(6-chloro-1,3-benzodioxol-5-yl)-3-methyl-1-benzofuran-2-carboxamide
CID 17423477

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide (CID 7899905) is N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide is Cc1c(C(=O)Nc2cc(Cl)ccc2Cl)oc2c1ccc1ccccc12.
What is the InChIKey of N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The InChIKey is RZWLVHBUYHJDPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2NO2/c1-11-14-8-6-12-4-2-3-5-15(12)19(14)25-18(11)20(24)23-17-10-13(21)7-9-16(17)22/h2-10H,1H3,(H,23,24).
What are the key properties of N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide?
N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide has a molecular weight of 370.24 g/mol, XLogP of 6.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide is sourced from PubChem (CID 7899905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).