1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone

C11H17N3O2 — CID 58468706

IUPAC1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)c2cnc[nH]2)CCO1
InChIInChI=1S/C11H17N3O2/c1-8(2)10-6-14(3-4-16-10)11(15)9-5-12-7-13-9/h5,7-8,10H,3-4,6H2,1-2H3,(H,12,13)
InChIKeyQXRIMQYXFSSBBS-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.91
Rot. Bonds2

About 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone

1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone (PubChem CID 58468706) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone
PubChem CID58468706
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)c2cnc[nH]2)CCO1
InChIInChI=1S/C11H17N3O2/c1-8(2)10-6-14(3-4-16-10)11(15)9-5-12-7-13-9/h5,7-8,10H,3-4,6H2,1-2H3,(H,12,13)
InChIKeyQXRIMQYXFSSBBS-UHFFFAOYSA-N
XLogP0.91
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone 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 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone?
The IUPAC name of 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone (CID 58468706) is 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone.
What is the SMILES notation for 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone?
The canonical SMILES for 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone is CC(C)C1CN(C(=O)c2cnc[nH]2)CCO1.
What is the InChIKey of 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone?
The InChIKey is QXRIMQYXFSSBBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8(2)10-6-14(3-4-16-10)11(15)9-5-12-7-13-9/h5,7-8,10H,3-4,6H2,1-2H3,(H,12,13).
What are the key properties of 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone?
1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone has a molecular weight of 223.28 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazol-5-yl-(2-propan-2-ylmorpholin-4-yl)methanone is sourced from PubChem (CID 58468706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).