2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide

C18H22N4O2S — CID 18130049

IUPAC2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCCCn1c(=O)n(CC(=O)Nc2nc(C(C)C)cs2)c2ccccc21
InChIInChI=1S/C18H22N4O2S/c1-4-9-21-14-7-5-6-8-15(14)22(18(21)24)10-16(23)20-17-19-13(11-25-17)12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,19,20,23)
InChIKeyDOFAPMFZOIJIIH-UHFFFAOYSA-N
MW358.47 g/mol
LogP3.43
Rot. Bonds6

About 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide

2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 18130049) has the molecular formula C18H22N4O2S and a molecular weight of 358.47 g/mol. Its IUPAC name is 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID18130049
Molecular FormulaC18H22N4O2S
Molecular Weight358.47 g/mol
Exact Mass358.15
IUPAC Name2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCCCn1c(=O)n(CC(=O)Nc2nc(C(C)C)cs2)c2ccccc21
InChIInChI=1S/C18H22N4O2S/c1-4-9-21-14-7-5-6-8-15(14)22(18(21)24)10-16(23)20-17-19-13(11-25-17)12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,19,20,23)
InChIKeyDOFAPMFZOIJIIH-UHFFFAOYSA-N
XLogP3.43
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.47
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-acetyl-1,3-thiazol-2-yl)-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 24524945
2-(2-methylindol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 43036916
N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 42380329
N-(5-methylhexan-2-yl)-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 46515927
N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 46522071
N-(4-propan-2-yl-1,3-thiazol-2-yl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide
CID 18130035
2-(4-oxoquinazolin-3-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 17450612
3-(2-oxo-3-propylbenzimidazol-1-yl)-N-(1-pyridin-2-ylethyl)propanamide
CID 24645457
2-(2-oxo-3-propylbenzimidazol-1-yl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 46470808
N-(1,3-benzothiazol-2-ylmethyl)-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 18110836
2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 18132597
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 51648189

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide (CID 18130049) is 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide is CCCn1c(=O)n(CC(=O)Nc2nc(C(C)C)cs2)c2ccccc21.
What is the InChIKey of 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is DOFAPMFZOIJIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2S/c1-4-9-21-14-7-5-6-8-15(14)22(18(21)24)10-16(23)20-17-19-13(11-25-17)12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,19,20,23).
What are the key properties of 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide?
2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 358.47 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 18130049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).