2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide

C17H23ClN4O3 — CID 60539322

IUPAC2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
SMILESCCC(C)(C)NC(=O)c1ccc(NCC(=O)N2CCNC2=O)cc1Cl
InChIInChI=1S/C17H23ClN4O3/c1-4-17(2,3)21-15(24)12-6-5-11(9-13(12)18)20-10-14(23)22-8-7-19-16(22)25/h5-6,9,20H,4,7-8,10H2,1-3H3,(H,19,25)(H,21,24)
InChIKeyZWAKFQZKZJVTNE-UHFFFAOYSA-N
MW366.85 g/mol
LogP2.22
Rot. Bonds6

About 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide

2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide (PubChem CID 60539322) has the molecular formula C17H23ClN4O3 and a molecular weight of 366.85 g/mol. Its IUPAC name is 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide.

Molecular Properties

Compound Name2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
PubChem CID60539322
Molecular FormulaC17H23ClN4O3
Molecular Weight366.85 g/mol
Exact Mass366.15
IUPAC Name2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
SMILESCCC(C)(C)NC(=O)c1ccc(NCC(=O)N2CCNC2=O)cc1Cl
InChIInChI=1S/C17H23ClN4O3/c1-4-17(2,3)21-15(24)12-6-5-11(9-13(12)18)20-10-14(23)22-8-7-19-16(22)25/h5-6,9,20H,4,7-8,10H2,1-3H3,(H,19,25)(H,21,24)
InChIKeyZWAKFQZKZJVTNE-UHFFFAOYSA-N
XLogP2.22
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide with MolForge

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Related Compounds

2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 60539228
2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(4-piperidin-1-ylanilino)ethyl]amino]benzamide
CID 60539115
2-chloro-N-(2-methylbutan-2-yl)-4-[[2-(methylcarbamoylamino)-2-oxoethyl]amino]benzamide
CID 60539304
2-chloro-4-[[2-(5-chloro-2-fluoroanilino)-2-oxoethyl]amino]-N-(2-methylbutan-2-yl)benzamide
CID 60539162
2-chloro-4-[[2-(2,3-dichloroanilino)-2-oxoethyl]amino]-N-(2-methylbutan-2-yl)benzamide
CID 60539073
1-[2-(4-ethoxyanilino)acetyl]imidazolidin-2-one
CID 134008026
4-[[2-(2-bromo-4-methylanilino)-2-oxoethyl]amino]-2-chloro-N-(2-methylbutan-2-yl)benzamide
CID 60539097
4-amino-2-chloro-N-(2-methylbutan-2-yl)benzamide
CID 16771675
N-methyl-2-[4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]phenyl]acetamide
CID 37231270
1-[2-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]acetyl]imidazolidin-2-one
CID 34082442
propyl 4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzoate
CID 24615008
N-[3-chloro-4-(2-methylbutan-2-ylcarbamoyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120624220

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The IUPAC name of 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide (CID 60539322) is 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide.
What is the SMILES notation for 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The canonical SMILES for 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide is CCC(C)(C)NC(=O)c1ccc(NCC(=O)N2CCNC2=O)cc1Cl.
What is the InChIKey of 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The InChIKey is ZWAKFQZKZJVTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN4O3/c1-4-17(2,3)21-15(24)12-6-5-11(9-13(12)18)20-10-14(23)22-8-7-19-16(22)25/h5-6,9,20H,4,7-8,10H2,1-3H3,(H,19,25)(H,21,24).
What are the key properties of 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide has a molecular weight of 366.85 g/mol, XLogP of 2.22, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-methylbutan-2-yl)-4-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide is sourced from PubChem (CID 60539322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).