N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide

C11H17N3O3 — CID 95275267

IUPACN-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide
SMILESCCN(C[C@H]1CCOC1)C(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C11H17N3O3/c1-2-14(6-8-3-4-17-7-8)10(15)9-5-12-11(16)13-9/h5,8H,2-4,6-7H2,1H3,(H2,12,13,16)/t8-/m1/s1
InChIKeyZMYNOMIILHOENG-MRVPVSSYSA-N
MW239.27 g/mol
LogP0.20
Rot. Bonds4

About N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide

N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide (PubChem CID 95275267) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide
PubChem CID95275267
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide
SMILESCCN(C[C@H]1CCOC1)C(=O)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C11H17N3O3/c1-2-14(6-8-3-4-17-7-8)10(15)9-5-12-11(16)13-9/h5,8H,2-4,6-7H2,1H3,(H2,12,13,16)/t8-/m1/s1
InChIKeyZMYNOMIILHOENG-MRVPVSSYSA-N
XLogP0.20
TPSA78.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-oxo-N-[[(3S)-oxolan-3-yl]methyl]-6-phenyl-1H-pyridine-3-carboxamide
CID 95977130
4-amino-N,5-diethyl-N-(oxolan-3-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62080957
N-ethyl-7-nitro-N-[[(3R)-oxolan-3-yl]methyl]-1H-indole-2-carboxamide
CID 94836383
3-bromo-N-ethyl-5-methyl-N-(oxolan-3-ylmethyl)benzamide
CID 104852419
N-ethyl-2-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide
CID 80719027
N-ethyl-6-nitro-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1H-quinoline-4-carboxamide
CID 95619761
N-ethyl-2-iodo-3-methyl-N-(oxolan-3-ylmethyl)benzamide
CID 113223582
5-amino-N-ethyl-N-(oxolan-3-ylmethyl)-1H-indazole-3-carboxamide
CID 61116521
4-(dimethylsulfamoyl)-N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]benzamide
CID 94805874
3-amino-2-chloro-N-ethyl-N-(oxolan-3-ylmethyl)benzamide
CID 112575684
3,6-dichloro-N-ethyl-N-(oxolan-3-ylmethyl)pyridine-2-carboxamide
CID 61051779
N-ethyl-3-methyl-4-oxo-N-(oxolan-3-ylmethyl)phthalazine-1-carboxamide
CID 51082580

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide (CID 95275267) is N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide is CCN(C[C@H]1CCOC1)C(=O)c1c[nH]c(=O)[nH]1.
What is the InChIKey of N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is ZMYNOMIILHOENG-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-2-14(6-8-3-4-17-7-8)10(15)9-5-12-11(16)13-9/h5,8H,2-4,6-7H2,1H3,(H2,12,13,16)/t8-/m1/s1.
What are the key properties of N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide?
N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 239.27 g/mol, XLogP of 0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-oxo-N-[[(3R)-oxolan-3-yl]methyl]-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 95275267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).