[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone

C11H16N4O4S — CID 128851929

IUPAC[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone
SMILESCc1onc(N)c1S(=O)(=O)N1CCN(C(=O)C2CC2)C1
InChIInChI=1S/C11H16N4O4S/c1-7-9(10(12)13-19-7)20(17,18)15-5-4-14(6-15)11(16)8-2-3-8/h8H,2-6H2,1H3,(H2,12,13)
InChIKeyLJSUGQZMLDKEAZ-UHFFFAOYSA-N
MW300.34 g/mol
LogP-0.23
Rot. Bonds3

About [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone

[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone (PubChem CID 128851929) has the molecular formula C11H16N4O4S and a molecular weight of 300.34 g/mol. Its IUPAC name is [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone.

Molecular Properties

Compound Name[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone
PubChem CID128851929
Molecular FormulaC11H16N4O4S
Molecular Weight300.34 g/mol
Exact Mass300.09
IUPAC Name[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone
SMILESCc1onc(N)c1S(=O)(=O)N1CCN(C(=O)C2CC2)C1
InChIInChI=1S/C11H16N4O4S/c1-7-9(10(12)13-19-7)20(17,18)15-5-4-14(6-15)11(16)8-2-3-8/h8H,2-6H2,1H3,(H2,12,13)
InChIKeyLJSUGQZMLDKEAZ-UHFFFAOYSA-N
XLogP-0.23
TPSA109.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone with MolForge

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Related Compounds

1-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxylic acid
CID 122070283
(3-aminocyclopentyl)-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]methanone;hydrochloride
CID 119697348
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone
CID 120618871
cyclopentyl-[4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carbonyl]piperazin-1-yl]methanone
CID 55566653
4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carbonyl]piperazine-1-carbaldehyde
CID 110335350
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-pyrrolidin-3-ylmethanone
CID 119697373
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazine-1-carbonyl]cyclobutane-1-carboxylic acid
CID 120975076
1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]ethanone
CID 3345472
5-methyl-4-(4-phenylpiperazin-1-yl)sulfonyl-1,2-oxazol-3-amine
CID 56920069
[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 51264936
1-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl]ethanone
CID 53118801
4-(2-ethylpiperidin-1-yl)sulfonyl-5-methyl-1,2-oxazol-3-amine
CID 56923137

Frequently Asked Questions

What is the IUPAC name of [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone?
The IUPAC name of [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone (CID 128851929) is [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone.
What is the SMILES notation for [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone?
The canonical SMILES for [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone is Cc1onc(N)c1S(=O)(=O)N1CCN(C(=O)C2CC2)C1.
What is the InChIKey of [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone?
The InChIKey is LJSUGQZMLDKEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4S/c1-7-9(10(12)13-19-7)20(17,18)15-5-4-14(6-15)11(16)8-2-3-8/h8H,2-6H2,1H3,(H2,12,13).
What are the key properties of [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone?
[3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone has a molecular weight of 300.34 g/mol, XLogP of -0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3-amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]imidazolidin-1-yl]-cyclopropylmethanone is sourced from PubChem (CID 128851929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).