2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide

C14H23N5O2 — CID 121495191

IUPAC2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide
SMILESCC(C)Cn1cncc1CNC(=O)CN1CCN(C)C1=O
InChIInChI=1S/C14H23N5O2/c1-11(2)8-19-10-15-6-12(19)7-16-13(20)9-18-5-4-17(3)14(18)21/h6,10-11H,4-5,7-9H2,1-3H3,(H,16,20)
InChIKeyWQORKLMEEKQEHI-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.52
Rot. Bonds6

About 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide

2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide (PubChem CID 121495191) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide
PubChem CID121495191
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide
SMILESCC(C)Cn1cncc1CNC(=O)CN1CCN(C)C1=O
InChIInChI=1S/C14H23N5O2/c1-11(2)8-19-10-15-6-12(19)7-16-13(20)9-18-5-4-17(3)14(18)21/h6,10-11H,4-5,7-9H2,1-3H3,(H,16,20)
InChIKeyWQORKLMEEKQEHI-UHFFFAOYSA-N
XLogP0.52
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide?
The IUPAC name of 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide (CID 121495191) is 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide?
The canonical SMILES for 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide is CC(C)Cn1cncc1CNC(=O)CN1CCN(C)C1=O.
What is the InChIKey of 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide?
The InChIKey is WQORKLMEEKQEHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-11(2)8-19-10-15-6-12(19)7-16-13(20)9-18-5-4-17(3)14(18)21/h6,10-11H,4-5,7-9H2,1-3H3,(H,16,20).
What are the key properties of 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide?
2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]acetamide is sourced from PubChem (CID 121495191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).