[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone

C12H19N3O3 — CID 91765329

IUPAC[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone
SMILESCOCCC1CN(C(=O)c2ncc(C)[nH]2)CCO1
InChIInChI=1S/C12H19N3O3/c1-9-7-13-11(14-9)12(16)15-4-6-18-10(8-15)3-5-17-2/h7,10H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyWOTZPHUMNGPOKH-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.60
Rot. Bonds4

About [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone

[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone (PubChem CID 91765329) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone.

Molecular Properties

Compound Name[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone
PubChem CID91765329
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone
SMILESCOCCC1CN(C(=O)c2ncc(C)[nH]2)CCO1
InChIInChI=1S/C12H19N3O3/c1-9-7-13-11(14-9)12(16)15-4-6-18-10(8-15)3-5-17-2/h7,10H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyWOTZPHUMNGPOKH-UHFFFAOYSA-N
XLogP0.60
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone?
The IUPAC name of [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone (CID 91765329) is [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone.
What is the SMILES notation for [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone?
The canonical SMILES for [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone is COCCC1CN(C(=O)c2ncc(C)[nH]2)CCO1.
What is the InChIKey of [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone?
The InChIKey is WOTZPHUMNGPOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-9-7-13-11(14-9)12(16)15-4-6-18-10(8-15)3-5-17-2/h7,10H,3-6,8H2,1-2H3,(H,13,14).
What are the key properties of [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone?
[2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone has a molecular weight of 253.30 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyethyl)morpholin-4-yl]-(5-methyl-1H-imidazol-2-yl)methanone is sourced from PubChem (CID 91765329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).