N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide

C13H19N5O4S — CID 91629000

IUPACN-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide
SMILESCS(=O)(=O)N1CCN(C(=O)NCCn2ccnc2C2CC2)C1=O
InChIInChI=1S/C13H19N5O4S/c1-23(21,22)18-9-8-17(13(18)20)12(19)15-5-7-16-6-4-14-11(16)10-2-3-10/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,19)
InChIKeyMFNNQNJUGLBJCP-UHFFFAOYSA-N
MW341.39 g/mol
LogP0.17
Rot. Bonds5

About N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide

N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide (PubChem CID 91629000) has the molecular formula C13H19N5O4S and a molecular weight of 341.39 g/mol. Its IUPAC name is N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide
PubChem CID91629000
Molecular FormulaC13H19N5O4S
Molecular Weight341.39 g/mol
Exact Mass341.12
IUPAC NameN-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide
SMILESCS(=O)(=O)N1CCN(C(=O)NCCn2ccnc2C2CC2)C1=O
InChIInChI=1S/C13H19N5O4S/c1-23(21,22)18-9-8-17(13(18)20)12(19)15-5-7-16-6-4-14-11(16)10-2-3-10/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,19)
InChIKeyMFNNQNJUGLBJCP-UHFFFAOYSA-N
XLogP0.17
TPSA104.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-(2-cyclopropyl-1H-imidazol-1-yl)ethyl)propane-1-sulfonamide
CID 91629001
N~2~-[(3S,4R)-4-[(Dimethylamino)methyl]-1-(methylsulfonyl)tetrahydro-1H-pyrrol-3-YL]-1-methyl-1H-imidazole-2-carboxamide
CID 91923124
(3S,4R)-3-(Cyclopropanecarbonylamino)-4-(1-methylimidazol-2-yl)pyrrolidine-1-sulfonyl fluoride
CID 154880960
2-(2-isopropyl-1H-imidazol-1-yl)-N-[2-(pyrrolidin-1-ylsulfonyl)ethyl]propanamide
CID 50958461
N-[2-(methanesulfonamido)-2-methylpropyl]imidazole-1-carboxamide
CID 63858497
1-[2-(2-Propylimidazol-1-yl)ethyl]imidazolidin-2-one
CID 64151803
N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrrolidine-3-sulfonamide
CID 65417252
N-[2-(1-methylimidazol-2-yl)ethyl]pyrrolidine-3-sulfonamide
CID 65420258
N-[3-[ethyl(methylsulfonyl)amino]propyl]imidazole-1-carboxamide
CID 81269671
1-[2-(2-Oxoimidazolidin-1-yl)ethyl]-2-propan-2-ylimidazole-4-sulfonamide
CID 81341052
N~1~-[cyclopropyl(1-methyl-1H-imidazol-2-yl)methyl]-N~3~-(methylsulfonyl)-beta-alaninamide
CID 91832424
N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 92108598

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide (CID 91629000) is N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide is CS(=O)(=O)N1CCN(C(=O)NCCn2ccnc2C2CC2)C1=O.
What is the InChIKey of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide?
The InChIKey is MFNNQNJUGLBJCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O4S/c1-23(21,22)18-9-8-17(13(18)20)12(19)15-5-7-16-6-4-14-11(16)10-2-3-10/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,19).
What are the key properties of N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide?
N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide has a molecular weight of 341.39 g/mol, XLogP of 0.17, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-cyclopropylimidazol-1-yl)ethyl]-3-methylsulfonyl-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 91629000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).