2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

C22H22N4O4 — CID 38112336

IUPAC2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCC(=O)c1nc2ccccc2n1CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C22H22N4O4/c1-15(27)21-24-18-4-2-3-5-19(18)26(21)14-20(28)23-17-8-6-16(7-9-17)22(29)25-10-12-30-13-11-25/h2-9H,10-14H2,1H3,(H,23,28)
InChIKeyMOFYVTRPLYLMFA-UHFFFAOYSA-N
MW406.44 g/mol
LogP2.35
Rot. Bonds5

About 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 38112336) has the molecular formula C22H22N4O4 and a molecular weight of 406.44 g/mol. Its IUPAC name is 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID38112336
Molecular FormulaC22H22N4O4
Molecular Weight406.44 g/mol
Exact Mass406.16
IUPAC Name2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCC(=O)c1nc2ccccc2n1CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C22H22N4O4/c1-15(27)21-24-18-4-2-3-5-19(18)26(21)14-20(28)23-17-8-6-16(7-9-17)22(29)25-10-12-30-13-11-25/h2-9H,10-14H2,1H3,(H,23,28)
InChIKeyMOFYVTRPLYLMFA-UHFFFAOYSA-N
XLogP2.35
TPSA93.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.44
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-acetylphenyl)-2-[2-(2-morpholin-4-yl-2-oxoethyl)benzimidazol-1-yl]acetamide
CID 4841360
2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 55532655
2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide
CID 5298813
2-[4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
CID 54832695
2-[2-(4-chlorobenzoyl)benzimidazol-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 46288978
2-(2-acetylbenzimidazol-1-yl)-N-(1-methylindazol-3-yl)acetamide
CID 46984636
1-(4-bromophenyl)-2-[2-(morpholine-4-carbothioyl)benzimidazol-1-yl]ethanone
CID 71605595
2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 54818171
N-[4-(morpholine-4-carbonyl)phenyl]-2-(naphthalen-2-ylamino)acetamide
CID 54839830
2-(2-chloroanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 54810418
2-[4-(morpholine-4-carbonyl)phenoxy]-N-phenylacetamide
CID 18837739
2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]acetamide
CID 24514213

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (CID 38112336) is 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is CC(=O)c1nc2ccccc2n1CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is MOFYVTRPLYLMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O4/c1-15(27)21-24-18-4-2-3-5-19(18)26(21)14-20(28)23-17-8-6-16(7-9-17)22(29)25-10-12-30-13-11-25/h2-9H,10-14H2,1H3,(H,23,28).
What are the key properties of 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 406.44 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylbenzimidazol-1-yl)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 38112336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).