2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide

C24H22FN3O — CID 46328474

IUPAC2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide
SMILESCn1c(CCc2ccccc2NC(=O)Cc2ccc(F)cc2)nc2ccccc21
InChIInChI=1S/C24H22FN3O/c1-28-22-9-5-4-8-21(22)26-23(28)15-12-18-6-2-3-7-20(18)27-24(29)16-17-10-13-19(25)14-11-17/h2-11,13-14H,12,15-16H2,1H3,(H,27,29)
InChIKeyXIZXMSSSAOVACU-UHFFFAOYSA-N
MW387.46 g/mol
LogP4.68
Rot. Bonds6

About 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide

2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide (PubChem CID 46328474) has the molecular formula C24H22FN3O and a molecular weight of 387.46 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide
PubChem CID46328474
Molecular FormulaC24H22FN3O
Molecular Weight387.46 g/mol
Exact Mass387.17
IUPAC Name2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide
SMILESCn1c(CCc2ccccc2NC(=O)Cc2ccc(F)cc2)nc2ccccc21
InChIInChI=1S/C24H22FN3O/c1-28-22-9-5-4-8-21(22)26-23(28)15-12-18-6-2-3-7-20(18)27-24(29)16-17-10-13-19(25)14-11-17/h2-11,13-14H,12,15-16H2,1H3,(H,27,29)
InChIKeyXIZXMSSSAOVACU-UHFFFAOYSA-N
XLogP4.68
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]-2-(4-methylphenyl)acetamide
CID 50784494
1-(2-chlorophenyl)-3-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]urea
CID 46382332
1-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]-3-phenylurea
CID 46382333
N-[4-(2-aminoethyl)phenyl]-2-(1-methylbenzimidazol-2-yl)acetamide
CID 21264572
2-(4-fluorophenoxy)-N-[(1-methylbenzimidazol-2-yl)methyl]acetamide
CID 110712039
(3R)-3-(4-fluorophenyl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]butanamide
CID 95324241
2-(4-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide
CID 16993804
N-[3-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]propanamide
CID 20933815
N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]pyridine-4-carboxamide
CID 46290663
3-(3-fluorophenyl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]propanamide
CID 110711966
2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521
N-[2-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-methylpropanamide
CID 976977

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide (CID 46328474) is 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide is Cn1c(CCc2ccccc2NC(=O)Cc2ccc(F)cc2)nc2ccccc21.
What is the InChIKey of 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide?
The InChIKey is XIZXMSSSAOVACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN3O/c1-28-22-9-5-4-8-21(22)26-23(28)15-12-18-6-2-3-7-20(18)27-24(29)16-17-10-13-19(25)14-11-17/h2-11,13-14H,12,15-16H2,1H3,(H,27,29).
What are the key properties of 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide?
2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide has a molecular weight of 387.46 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[2-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]acetamide is sourced from PubChem (CID 46328474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).