1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine

C20H43N3O — CID 142096789

IUPAC1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine
SMILESCC1CCN(C)CC1.CCC1CCN(C)CC1.CN1CCOCC1
InChIInChI=1S/C8H17N.C7H15N.C5H11NO/c1-3-8-4-6-9(2)7-5-8;1-7-3-5-8(2)6-4-7;1-6-2-4-7-5-3-6/h8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2-5H2,1H3
InChIKeyQCDHNQJUSRLKKM-UHFFFAOYSA-N
MW341.58 g/mol
LogP3.03
Rot. Bonds1

About 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine

1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine (PubChem CID 142096789) has the molecular formula C20H43N3O and a molecular weight of 341.58 g/mol. Its IUPAC name is 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine.

Molecular Properties

Compound Name1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine
PubChem CID142096789
Molecular FormulaC20H43N3O
Molecular Weight341.58 g/mol
Exact Mass341.34
IUPAC Name1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine
SMILESCC1CCN(C)CC1.CCC1CCN(C)CC1.CN1CCOCC1
InChIInChI=1S/C8H17N.C7H15N.C5H11NO/c1-3-8-4-6-9(2)7-5-8;1-7-3-5-8(2)6-4-7;1-6-2-4-7-5-3-6/h8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2-5H2,1H3
InChIKeyQCDHNQJUSRLKKM-UHFFFAOYSA-N
XLogP3.03
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.58
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-1-methylpiperidine;formonitrile
CID 175849532
4-ethyl-1-methylpiperidine;methoxymethane
CID 90698783
4-fluoro-1-methylpiperidine;4-methylmorpholine
CID 153371912
butane;bis(4-methylmorpholine)
CID 159010392
6-ethyl-1,4-dimethyl-1,4-diazocane
CID 174327849
4-ethyl-1-pentylpiperidine;methyl hydrogen carbonate;4-methylmorpholine
CID 174804809
19-methyl-1,4,7,10,13,16-hexaoxa-19-azacyclohenicosane
CID 6612303
ethane;4-methylmorpholine
CID 54432133
3-ethyl-1-methylpyrrolidine;methane
CID 161184146
4-[(4-methylpiperidin-1-yl)methyl]morpholine
CID 155208667
bis(3-ethyl-1-methylpyrrolidine);1-methylpyrrolidine
CID 161292212
1,4-dimethylpiperidine;ethane;heptane
CID 156708934

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine?
The IUPAC name of 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine (CID 142096789) is 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine.
What is the SMILES notation for 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine?
The canonical SMILES for 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine is CC1CCN(C)CC1.CCC1CCN(C)CC1.CN1CCOCC1.
What is the InChIKey of 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine?
The InChIKey is QCDHNQJUSRLKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C7H15N.C5H11NO/c1-3-8-4-6-9(2)7-5-8;1-7-3-5-8(2)6-4-7;1-6-2-4-7-5-3-6/h8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2-5H2,1H3.
What are the key properties of 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine?
1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine has a molecular weight of 341.58 g/mol, XLogP of 3.03, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperidine;4-ethyl-1-methylpiperidine;4-methylmorpholine is sourced from PubChem (CID 142096789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).