(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol

C12H21N3O2 — CID 79087761

IUPAC(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)C1CN(C)CCO1
InChIInChI=1S/C12H21N3O2/c1-3-5-15-6-4-13-12(15)11(16)10-9-14(2)7-8-17-10/h4,6,10-11,16H,3,5,7-9H2,1-2H3
InChIKeyDOZODWGZALOREZ-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.66
Rot. Bonds4

About (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol

(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol (PubChem CID 79087761) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol.

Molecular Properties

Compound Name(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol
PubChem CID79087761
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)C1CN(C)CCO1
InChIInChI=1S/C12H21N3O2/c1-3-5-15-6-4-13-12(15)11(16)10-9-14(2)7-8-17-10/h4,6,10-11,16H,3,5,7-9H2,1-2H3
InChIKeyDOZODWGZALOREZ-UHFFFAOYSA-N
XLogP0.66
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-methylmorpholin-2-yl)-2-(1-propylimidazol-2-yl)ethyl]propan-1-amine
CID 79752801
(3-methyloxolan-2-yl)-(1-propylimidazol-2-yl)methanol
CID 115799314
3-bicyclo[3.1.0]hexanyl-(1-propylimidazol-2-yl)methanol
CID 115799261
(4-ethylcyclohexyl)-(1-propylimidazol-2-yl)methanol
CID 65393927
[(4-propan-2-ylmorpholin-2-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105248109
oxolan-2-yl-(1-propylimidazol-2-yl)methanamine
CID 65331088
3-(1-methylimidazol-2-yl)-1-(4-methylmorpholin-2-yl)propan-1-ol
CID 114529802
(4-bromo-1-propylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methanol
CID 114644622
N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine
CID 65328911
1-(oxan-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821107
[(1-methylimidazol-2-yl)-(4-methylmorpholin-2-yl)methyl]hydrazine
CID 105244400
N-[1,4-oxathian-2-yl-(1-propylimidazol-2-yl)methyl]ethanamine
CID 79962860

Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol?
The IUPAC name of (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol (CID 79087761) is (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol.
What is the SMILES notation for (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol?
The canonical SMILES for (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol is CCCn1ccnc1C(O)C1CN(C)CCO1.
What is the InChIKey of (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol?
The InChIKey is DOZODWGZALOREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-3-5-15-6-4-13-12(15)11(16)10-9-14(2)7-8-17-10/h4,6,10-11,16H,3,5,7-9H2,1-2H3.
What are the key properties of (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol?
(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol has a molecular weight of 239.32 g/mol, XLogP of 0.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol is sourced from PubChem (CID 79087761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).