(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine

C18H33NO3 — CID 129430506

IUPAC(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine
SMILESCOCCC1(CN2CCO[C@@H]([C@H]3CCCO3)C2)CCCCC1
InChIInChI=1S/C18H33NO3/c1-20-12-9-18(7-3-2-4-8-18)15-19-10-13-22-17(14-19)16-6-5-11-21-16/h16-17H,2-15H2,1H3/t16-,17-/m1/s1
InChIKeyLNORNDXWJQEAPR-IAGOWNOFSA-N
MW311.47 g/mol
LogP2.85
Rot. Bonds6

About (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine

(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine (PubChem CID 129430506) has the molecular formula C18H33NO3 and a molecular weight of 311.47 g/mol. Its IUPAC name is (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine.

Molecular Properties

Compound Name(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine
PubChem CID129430506
Molecular FormulaC18H33NO3
Molecular Weight311.47 g/mol
Exact Mass311.25
IUPAC Name(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine
SMILESCOCCC1(CN2CCO[C@@H]([C@H]3CCCO3)C2)CCCCC1
InChIInChI=1S/C18H33NO3/c1-20-12-9-18(7-3-2-4-8-18)15-19-10-13-22-17(14-19)16-6-5-11-21-16/h16-17H,2-15H2,1H3/t16-,17-/m1/s1
InChIKeyLNORNDXWJQEAPR-IAGOWNOFSA-N
XLogP2.85
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.47
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The IUPAC name of (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine (CID 129430506) is (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine.
What is the SMILES notation for (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The canonical SMILES for (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine is COCCC1(CN2CCO[C@@H]([C@H]3CCCO3)C2)CCCCC1.
What is the InChIKey of (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The InChIKey is LNORNDXWJQEAPR-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H33NO3/c1-20-12-9-18(7-3-2-4-8-18)15-19-10-13-22-17(14-19)16-6-5-11-21-16/h16-17H,2-15H2,1H3/t16-,17-/m1/s1.
What are the key properties of (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine?
(2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine has a molecular weight of 311.47 g/mol, XLogP of 2.85, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[[1-(2-methoxyethyl)cyclohexyl]methyl]-2-[(2R)-oxolan-2-yl]morpholine is sourced from PubChem (CID 129430506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).