(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine

C28H60N4O2 — CID 162056915

IUPAC(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine
SMILESCC1CCCCN1C.CCC1CCCCN1C.C[C@@H]1CN(C)C[C@H](C)O1.C[C@@H]1COCCN1C
InChIInChI=1S/C8H17N.C7H15NO.C7H15N.C6H13NO/c1-3-8-6-4-5-7-9(8)2;1-6-4-8(3)5-7(2)9-6;1-7-5-3-4-6-8(7)2;1-6-5-8-4-3-7(6)2/h8H,3-7H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3/t;6-,7+;;6-/m...1/s1
InChIKeyYZHQPKIIBUJOPM-NXLOXGHUSA-N
MW484.81 g/mol
LogP4.43
Rot. Bonds1

About (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine

(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine (PubChem CID 162056915) has the molecular formula C28H60N4O2 and a molecular weight of 484.81 g/mol. Its IUPAC name is (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine.

Molecular Properties

Compound Name(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine
PubChem CID162056915
Molecular FormulaC28H60N4O2
Molecular Weight484.81 g/mol
Exact Mass484.47
IUPAC Name(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine
SMILESCC1CCCCN1C.CCC1CCCCN1C.C[C@@H]1CN(C)C[C@H](C)O1.C[C@@H]1COCCN1C
InChIInChI=1S/C8H17N.C7H15NO.C7H15N.C6H13NO/c1-3-8-6-4-5-7-9(8)2;1-6-4-8(3)5-7(2)9-6;1-7-5-3-4-6-8(7)2;1-6-5-8-4-3-7(6)2/h8H,3-7H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3/t;6-,7+;;6-/m...1/s1
InChIKeyYZHQPKIIBUJOPM-NXLOXGHUSA-N
XLogP4.43
TPSA31.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.81
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine with MolForge

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Launch Full Analysis

Related Compounds

(2R)-2-ethyl-1-methylpyrrolidine;hydrofluoride
CID 162730747
(2R)-2-ethyl-1-methylpiperidine
CID 67552955
(3S)-3-ethyl-4-methylmorpholine
CID 130351596
3,4-dimethylmorpholine;ethane;4-methylmorpholine
CID 145315669
(3R)-3,4-dimethyl-1,4-oxazepane
CID 67472015
(3R)-3,4-dimethyl-1,4-oxazepane;ethane
CID 178147511
1,2-dimethyl-azacyclododecane
CID 70316000
1,2-dimethyl-azacyclotetradecane
CID 70834681
1,4-dimethylpiperidine;methane;1-methylpiperidine;2,4,6-trimethylmorpholine
CID 158607105
N-[(1-methylpyrrolidin-2-yl)methyl]oxolan-3-amine
CID 115688929
ethane;(2S,6R)-2,4,6-trimethylmorpholine
CID 142013694
3,4-dimethylmorpholine;ethane;2-methylmorpholine
CID 172583303

Frequently Asked Questions

What is the IUPAC name of (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine?
The IUPAC name of (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine (CID 162056915) is (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine.
What is the SMILES notation for (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine?
The canonical SMILES for (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine is CC1CCCCN1C.CCC1CCCCN1C.C[C@@H]1CN(C)C[C@H](C)O1.C[C@@H]1COCCN1C.
What is the InChIKey of (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine?
The InChIKey is YZHQPKIIBUJOPM-NXLOXGHUSA-N. The full InChI is InChI=1S/C8H17N.C7H15NO.C7H15N.C6H13NO/c1-3-8-6-4-5-7-9(8)2;1-6-4-8(3)5-7(2)9-6;1-7-5-3-4-6-8(7)2;1-6-5-8-4-3-7(6)2/h8H,3-7H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3/t;6-,7+;;6-/m...1/s1.
What are the key properties of (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine?
(3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine has a molecular weight of 484.81 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3,4-dimethylmorpholine;1,2-dimethylpiperidine;2-ethyl-1-methylpiperidine;(2R,6S)-2,4,6-trimethylmorpholine is sourced from PubChem (CID 162056915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).