(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide

C8H10N4O2S — CID 164629686

IUPAC(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide
SMILESCc1cnc(NC(=O)[C@@H]2CNC(=O)N2)s1
InChIInChI=1S/C8H10N4O2S/c1-4-2-10-8(15-4)12-6(13)5-3-9-7(14)11-5/h2,5H,3H2,1H3,(H2,9,11,14)(H,10,12,13)/t5-/m0/s1
InChIKeyXJDHNLOKTURNSX-YFKPBYRVSA-N
MW226.26 g/mol
LogP0.07
Rot. Bonds2

About (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide

(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide (PubChem CID 164629686) has the molecular formula C8H10N4O2S and a molecular weight of 226.26 g/mol. Its IUPAC name is (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide
PubChem CID164629686
Molecular FormulaC8H10N4O2S
Molecular Weight226.26 g/mol
Exact Mass226.05
IUPAC Name(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide
SMILESCc1cnc(NC(=O)[C@@H]2CNC(=O)N2)s1
InChIInChI=1S/C8H10N4O2S/c1-4-2-10-8(15-4)12-6(13)5-3-9-7(14)11-5/h2,5H,3H2,1H3,(H2,9,11,14)(H,10,12,13)/t5-/m0/s1
InChIKeyXJDHNLOKTURNSX-YFKPBYRVSA-N
XLogP0.07
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide (CID 164629686) is (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide is Cc1cnc(NC(=O)[C@@H]2CNC(=O)N2)s1.
What is the InChIKey of (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide?
The InChIKey is XJDHNLOKTURNSX-YFKPBYRVSA-N. The full InChI is InChI=1S/C8H10N4O2S/c1-4-2-10-8(15-4)12-6(13)5-3-9-7(14)11-5/h2,5H,3H2,1H3,(H2,9,11,14)(H,10,12,13)/t5-/m0/s1.
What are the key properties of (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide?
(4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide has a molecular weight of 226.26 g/mol, XLogP of 0.07, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 164629686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).