2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine

C19H42N2O2 — CID 169200569

IUPAC2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine
SMILESCC.CC(C)N1CCO[C@H](C)C1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C9H19NO.C8H17NO.C2H6/c1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)9-4-5-10-8(3)6-9;1-2/h7-9H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;1-2H3/t;8-;/m.1./s1
InChIKeyGNYULDPNCRKDGO-RORZRARGSA-N
MW330.56 g/mol
LogP3.65
Rot. Bonds2

About 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine

2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine (PubChem CID 169200569) has the molecular formula C19H42N2O2 and a molecular weight of 330.56 g/mol. Its IUPAC name is 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine
PubChem CID169200569
Molecular FormulaC19H42N2O2
Molecular Weight330.56 g/mol
Exact Mass330.32
IUPAC Name2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine
SMILESCC.CC(C)N1CCO[C@H](C)C1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C9H19NO.C8H17NO.C2H6/c1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)9-4-5-10-8(3)6-9;1-2/h7-9H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;1-2H3/t;8-;/m.1./s1
InChIKeyGNYULDPNCRKDGO-RORZRARGSA-N
XLogP3.65
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.56
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine?
The IUPAC name of 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine (CID 169200569) is 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine.
What is the SMILES notation for 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine?
The canonical SMILES for 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine is CC.CC(C)N1CCO[C@H](C)C1.CC1CN(C(C)C)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine?
The InChIKey is GNYULDPNCRKDGO-RORZRARGSA-N. The full InChI is InChI=1S/C9H19NO.C8H17NO.C2H6/c1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)9-4-5-10-8(3)6-9;1-2/h7-9H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;1-2H3/t;8-;/m.1./s1.
What are the key properties of 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine?
2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine has a molecular weight of 330.56 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-propan-2-ylmorpholine;ethane;(2R)-2-methyl-4-propan-2-ylmorpholine is sourced from PubChem (CID 169200569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).