(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one

C11H16N4O2 — CID 140625284

IUPAC(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one
SMILESCOc1cnc(N2C[C@H](C(C)C)NC2=O)nc1
InChIInChI=1S/C11H16N4O2/c1-7(2)9-6-15(11(16)14-9)10-12-4-8(17-3)5-13-10/h4-5,7,9H,6H2,1-3H3,(H,14,16)/t9-/m1/s1
InChIKeyNPOKUGZPRFXLCC-SECBINFHSA-N
MW236.27 g/mol
LogP1.04
Rot. Bonds3

About (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one

(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one (PubChem CID 140625284) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one
PubChem CID140625284
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one
SMILESCOc1cnc(N2C[C@H](C(C)C)NC2=O)nc1
InChIInChI=1S/C11H16N4O2/c1-7(2)9-6-15(11(16)14-9)10-12-4-8(17-3)5-13-10/h4-5,7,9H,6H2,1-3H3,(H,14,16)/t9-/m1/s1
InChIKeyNPOKUGZPRFXLCC-SECBINFHSA-N
XLogP1.04
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one?
The IUPAC name of (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one (CID 140625284) is (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one?
The canonical SMILES for (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one is COc1cnc(N2C[C@H](C(C)C)NC2=O)nc1.
What is the InChIKey of (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one?
The InChIKey is NPOKUGZPRFXLCC-SECBINFHSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-7(2)9-6-15(11(16)14-9)10-12-4-8(17-3)5-13-10/h4-5,7,9H,6H2,1-3H3,(H,14,16)/t9-/m1/s1.
What are the key properties of (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one?
(4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one has a molecular weight of 236.27 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-1-(5-methoxypyrimidin-2-yl)-4-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 140625284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).