1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol

C11H19N3O2 — CID 109411165

IUPAC1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol
SMILESCc1nccn1CC(O)CN1CCOCC1
InChIInChI=1S/C11H19N3O2/c1-10-12-2-3-14(10)9-11(15)8-13-4-6-16-7-5-13/h2-3,11,15H,4-9H2,1H3
InChIKeyOOTAAZUNLZJUJJ-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.12
Rot. Bonds4

About 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol

1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol (PubChem CID 109411165) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol
PubChem CID109411165
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol
SMILESCc1nccn1CC(O)CN1CCOCC1
InChIInChI=1S/C11H19N3O2/c1-10-12-2-3-14(10)9-11(15)8-13-4-6-16-7-5-13/h2-3,11,15H,4-9H2,1H3
InChIKeyOOTAAZUNLZJUJJ-UHFFFAOYSA-N
XLogP-0.12
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 154737586
(2S)-3-morpholin-4-ylpropane-1,2-diol
CID 1268043
4-[6-[4-[2-(2-methylimidazol-1-yl)ethyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 166189579
(2R)-1-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95316342
1-[2-(1,3-dioxolan-2-yl)butyl]-2-methylimidazole
CID 67927543
1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]-3-morpholin-4-ylpropan-2-ol
CID 133488582
1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol
CID 104753089
(2R)-1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol
CID 696935
(2S)-1-(aziridin-1-yl)-3-(2-nitroimidazol-1-yl)propan-2-ol
CID 54146711
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449
4-(1-chloroethyl)-1-[2-(2-methylimidazol-1-yl)ethyl]piperidine
CID 106838160
ethane;1-(4-methylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 144771734

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol (CID 109411165) is 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol is Cc1nccn1CC(O)CN1CCOCC1.
What is the InChIKey of 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol?
The InChIKey is OOTAAZUNLZJUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-10-12-2-3-14(10)9-11(15)8-13-4-6-16-7-5-13/h2-3,11,15H,4-9H2,1H3.
What are the key properties of 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol?
1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol has a molecular weight of 225.29 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylimidazol-1-yl)-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 109411165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).