2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one

C11H17N3O2 — CID 63811149

IUPAC2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one
SMILESCc1nccn1C(C)C(=O)N1CCOCC1
InChIInChI=1S/C11H17N3O2/c1-9(14-4-3-12-10(14)2)11(15)13-5-7-16-8-6-13/h3-4,9H,5-8H2,1-2H3
InChIKeyZAOQVWIGXDXSGT-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.61
Rot. Bonds2

About 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one

2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one (PubChem CID 63811149) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one
PubChem CID63811149
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one
SMILESCc1nccn1C(C)C(=O)N1CCOCC1
InChIInChI=1S/C11H17N3O2/c1-9(14-4-3-12-10(14)2)11(15)13-5-7-16-8-6-13/h3-4,9H,5-8H2,1-2H3
InChIKeyZAOQVWIGXDXSGT-UHFFFAOYSA-N
XLogP0.61
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one with MolForge

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

Launch Full Analysis

Related Compounds

2-hydroxysulfanyl-2-(2-methylimidazol-1-yl)-1-morpholin-4-ylethanone
CID 57211832
(2R)-2-(2-methylimidazol-1-yl)-1-[4-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]propan-1-one
CID 126441847
(2S)-1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-2-(2-propan-2-ylimidazol-1-yl)propan-1-one
CID 97277363
(2R)-1-[4-(1-adamantyl)piperazin-1-yl]-2-(2-methylimidazol-1-yl)propan-1-one
CID 95871198
4-methyl-9-[(2R)-2-(2-methylimidazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 126450488
(2R)-2-(2-methylimidazol-1-yl)-1-[4-[(3-methyl-2-pyridinyl)methyl]piperazin-1-yl]propan-1-one
CID 126445384
2-hydroxysulfanyl-4-(2-methylimidazol-1-yl)-1-morpholin-4-ylbutan-1-one
CID 91508131
1-morpholin-4-yl-2-pyrazol-1-ylpropan-1-one
CID 51076822
1-morpholin-4-yl-2-pyrrol-1-ylpropan-1-one
CID 112690185
(3R)-3-(2-methylimidazol-1-yl)-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperidin-1-yl]butan-1-one
CID 95851745
3-(2-methylimidazol-1-yl)-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperidin-1-yl]butan-1-one
CID 110244178
1-[(2R)-2-(2-methylimidazol-1-yl)propanoyl]-4-(4-methylpyrazol-1-yl)piperidine-4-carboxylic acid
CID 95870233

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one (CID 63811149) is 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one is Cc1nccn1C(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one?
The InChIKey is ZAOQVWIGXDXSGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-9(14-4-3-12-10(14)2)11(15)13-5-7-16-8-6-13/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one?
2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one has a molecular weight of 223.28 g/mol, XLogP of 0.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazol-1-yl)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 63811149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).