4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide

C20H18ClNO2 — CID 35345535

IUPAC4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide
SMILESCc1ccc(N(Cc2ccco2)C(=O)c2ccc(Cl)cc2)cc1C
InChIInChI=1S/C20H18ClNO2/c1-14-5-10-18(12-15(14)2)22(13-19-4-3-11-24-19)20(23)16-6-8-17(21)9-7-16/h3-12H,13H2,1-2H3
InChIKeyMPJUPFVBUJBBAO-UHFFFAOYSA-N
MW339.82 g/mol
LogP5.40
Rot. Bonds4

About 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide

4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide (PubChem CID 35345535) has the molecular formula C20H18ClNO2 and a molecular weight of 339.82 g/mol. Its IUPAC name is 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide
PubChem CID35345535
Molecular FormulaC20H18ClNO2
Molecular Weight339.82 g/mol
Exact Mass339.10
IUPAC Name4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide
SMILESCc1ccc(N(Cc2ccco2)C(=O)c2ccc(Cl)cc2)cc1C
InChIInChI=1S/C20H18ClNO2/c1-14-5-10-18(12-15(14)2)22(13-19-4-3-11-24-19)20(23)16-6-8-17(21)9-7-16/h3-12H,13H2,1-2H3
InChIKeyMPJUPFVBUJBBAO-UHFFFAOYSA-N
XLogP5.40
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.82
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-N-(furan-2-ylmethyl)-4-propoxybenzamide
CID 35181958
N-(3-chlorophenyl)-N-(furan-2-ylmethyl)benzamide
CID 35182283
3,5-difluoro-N-(furan-2-ylmethyl)-N-(4-methylphenyl)benzamide
CID 18226162
2-amino-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 39364356
3-chloro-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)-6-methyl-1-benzothiophene-2-carboxamide
CID 35182108
N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3,4-dimethylbenzamide
CID 30708678
2-chloro-N-(3-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 39384213
3-chloro-N-(3,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)benzamide
CID 17014005
1-(4-chlorophenyl)-3-[furan-2-ylmethyl(methyl)amino]propan-1-one
CID 62619027
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(furan-2-ylmethyl)-4-methoxybenzamide
CID 1176022
4-(difluoromethoxy)-N-(furan-2-ylmethyl)-3-methoxy-N-(4-methylphenyl)benzamide
CID 18267461
3-(N-acetyl-3,4-dimethylanilino)-N-(furan-2-ylmethyl)propanamide
CID 113124484

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide (CID 35345535) is 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide is Cc1ccc(N(Cc2ccco2)C(=O)c2ccc(Cl)cc2)cc1C.
What is the InChIKey of 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide?
The InChIKey is MPJUPFVBUJBBAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClNO2/c1-14-5-10-18(12-15(14)2)22(13-19-4-3-11-24-19)20(23)16-6-8-17(21)9-7-16/h3-12H,13H2,1-2H3.
What are the key properties of 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide?
4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide has a molecular weight of 339.82 g/mol, XLogP of 5.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3,4-dimethylphenyl)-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 35345535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).