2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide

C20H16ClN3O2 — CID 155963168

IUPAC2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)c(Cl)c1
InChIInChI=1S/C20H16ClN3O2/c1-12-4-5-13(15(21)9-12)10-19(25)22-14-6-7-16-17(11-14)24-20(23-16)18-3-2-8-26-18/h2-9,11H,10H2,1H3,(H,22,25)(H,23,24)
InChIKeyTZBVLJIIXHFZOF-UHFFFAOYSA-N
MW365.82 g/mol
LogP4.97
Rot. Bonds4

About 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide

2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide (PubChem CID 155963168) has the molecular formula C20H16ClN3O2 and a molecular weight of 365.82 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide
PubChem CID155963168
Molecular FormulaC20H16ClN3O2
Molecular Weight365.82 g/mol
Exact Mass365.09
IUPAC Name2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide
SMILESCc1ccc(CC(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)c(Cl)c1
InChIInChI=1S/C20H16ClN3O2/c1-12-4-5-13(15(21)9-12)10-19(25)22-14-6-7-16-17(11-14)24-20(23-16)18-3-2-8-26-18/h2-9,11H,10H2,1H3,(H,22,25)(H,23,24)
InChIKeyTZBVLJIIXHFZOF-UHFFFAOYSA-N
XLogP4.97
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-6-methylpyridazine-4-carboxamide
CID 99790473
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide
CID 119843774
methyl 1-[[2-(furan-2-yl)-3H-benzimidazol-5-yl]carbamoyl]cyclopropane-1-carboxylate
CID 86795214
4-ethyl-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]thiadiazole-5-carboxamide
CID 47067261
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-5-nitrofuran-2-carboxamide
CID 60557174
3-(6-bromo-4-oxoquinazolin-3-yl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]propanamide
CID 60526152
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-4-(pyrazol-1-ylmethyl)benzamide
CID 52692587
3-(diethylsulfamoyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]benzamide
CID 60526245
N-[2-(2,6-dichlorophenyl)-3H-benzimidazol-5-yl]-2-phenylacetamide
CID 25066173
6-chloro-2-(furan-2-yl)-1H-benzimidazole
CID 5056728
3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]propanamide
CID 55863007
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
CID 55945477

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide?
The IUPAC name of 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide (CID 155963168) is 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide.
What is the SMILES notation for 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide?
The canonical SMILES for 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide is Cc1ccc(CC(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide?
The InChIKey is TZBVLJIIXHFZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O2/c1-12-4-5-13(15(21)9-12)10-19(25)22-14-6-7-16-17(11-14)24-20(23-16)18-3-2-8-26-18/h2-9,11H,10H2,1H3,(H,22,25)(H,23,24).
What are the key properties of 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide?
2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide has a molecular weight of 365.82 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]acetamide is sourced from PubChem (CID 155963168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).