2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide

C18H20N4O4S — CID 110626063

IUPAC2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)C(NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1
InChIInChI=1S/C18H20N4O4S/c1-11(2)19-17(23)16(12-6-4-3-5-7-12)22-27(25,26)13-8-9-14-15(10-13)21-18(24)20-14/h3-11,16,22H,1-2H3,(H,19,23)(H2,20,21,24)
InChIKeyDCRIIIYKIRRKKP-UHFFFAOYSA-N
MW388.45 g/mol
LogP1.40
Rot. Bonds6

About 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide

2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide (PubChem CID 110626063) has the molecular formula C18H20N4O4S and a molecular weight of 388.45 g/mol. Its IUPAC name is 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
PubChem CID110626063
Molecular FormulaC18H20N4O4S
Molecular Weight388.45 g/mol
Exact Mass388.12
IUPAC Name2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)C(NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1
InChIInChI=1S/C18H20N4O4S/c1-11(2)19-17(23)16(12-6-4-3-5-7-12)22-27(25,26)13-8-9-14-15(10-13)21-18(24)20-14/h3-11,16,22H,1-2H3,(H,19,23)(H2,20,21,24)
InChIKeyDCRIIIYKIRRKKP-UHFFFAOYSA-N
XLogP1.40
TPSA123.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 51.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(1,3-benzodioxol-5-ylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
CID 110286688
2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 42917034
(2S)-2-phenyl-N-propan-2-yl-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 110286716
2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]butanoic acid
CID 43405402
(2S)-2-[(2-chlorophenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286720
(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
CID 110286664
(2S)-2-[(2,5-dimethylphenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286675
2,3-dioxo-N-propan-2-yl-1,4-dihydroquinoxaline-6-sulfonamide
CID 866306
3-(4-fluorophenyl)-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid
CID 45439311
N-methyl-2-oxo-N-[(1S)-1-phenylethyl]-1,3-dihydrobenzimidazole-5-sulfonamide
CID 8819167
2-oxo-N-[(1R)-1-thiophen-2-ylethyl]-1,3-dihydrobenzimidazole-5-sulfonamide
CID 8798860
2-[methyl-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]-N-propan-2-ylacetamide
CID 8815647

Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide (CID 110626063) is 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide is CC(C)NC(=O)C(NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1.
What is the InChIKey of 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide?
The InChIKey is DCRIIIYKIRRKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O4S/c1-11(2)19-17(23)16(12-6-4-3-5-7-12)22-27(25,26)13-8-9-14-15(10-13)21-18(24)20-14/h3-11,16,22H,1-2H3,(H,19,23)(H2,20,21,24).
What are the key properties of 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide?
2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide has a molecular weight of 388.45 g/mol, XLogP of 1.40, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 110626063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).