4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol

C12H25NO2 — CID 79087851

IUPAC4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol
SMILESCN1CCOC(C(O)CCC(C)(C)C)C1
InChIInChI=1S/C12H25NO2/c1-12(2,3)6-5-10(14)11-9-13(4)7-8-15-11/h10-11,14H,5-9H2,1-4H3
InChIKeyQBISRZOLEQQELX-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.50
Rot. Bonds3

About 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol

4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol (PubChem CID 79087851) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol.

Molecular Properties

Compound Name4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol
PubChem CID79087851
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol
SMILESCN1CCOC(C(O)CCC(C)(C)C)C1
InChIInChI=1S/C12H25NO2/c1-12(2,3)6-5-10(14)11-9-13(4)7-8-15-11/h10-11,14H,5-9H2,1-4H3
InChIKeyQBISRZOLEQQELX-UHFFFAOYSA-N
XLogP1.50
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(4-methylmorpholin-2-yl)pentan-1-ol
CID 79087186
2-cyclopentyl-1-(4-methylmorpholin-2-yl)ethanol
CID 79087571
1-(4-methylmorpholin-2-yl)-4-methylsulfonylbutan-1-ol
CID 79087192
2-(4-tert-butylphenyl)-1-(4-methylmorpholin-2-yl)ethanol
CID 79086894
1-(4-methylmorpholin-2-yl)ethanol;hydrate
CID 173248751
(2R)-4-methyl-2-propan-2-ylmorpholine
CID 155242186
3-(1-methylimidazol-2-yl)-1-(4-methylmorpholin-2-yl)propan-1-ol
CID 114529802
2-(dichloromethyl)-4-methylmorpholine
CID 139654530
(4-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanol
CID 79087190
2-(3-fluorophenyl)-1-(4-methylmorpholin-2-yl)ethanol
CID 79087183
3-(2,3-dihydro-1-benzofuran-5-yl)-1-(4-methylmorpholin-2-yl)propan-1-ol
CID 79087386
1-(4-propylmorpholin-2-yl)pentan-1-ol
CID 79668705

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol?
The IUPAC name of 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol (CID 79087851) is 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol.
What is the SMILES notation for 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol?
The canonical SMILES for 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol is CN1CCOC(C(O)CCC(C)(C)C)C1.
What is the InChIKey of 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol?
The InChIKey is QBISRZOLEQQELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-12(2,3)6-5-10(14)11-9-13(4)7-8-15-11/h10-11,14H,5-9H2,1-4H3.
What are the key properties of 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol?
4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-1-(4-methylmorpholin-2-yl)pentan-1-ol is sourced from PubChem (CID 79087851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).