1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one

C14H27N3O — CID 83023930

IUPAC1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one
SMILESCCNC1CCCN(N2C(C)CCCC2C)C1=O
InChIInChI=1S/C14H27N3O/c1-4-15-13-9-6-10-16(14(13)18)17-11(2)7-5-8-12(17)3/h11-13,15H,4-10H2,1-3H3
InChIKeyOPEDIAZVDMACHE-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.76
Rot. Bonds3

About 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one

1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one (PubChem CID 83023930) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one
PubChem CID83023930
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one
SMILESCCNC1CCCN(N2C(C)CCCC2C)C1=O
InChIInChI=1S/C14H27N3O/c1-4-15-13-9-6-10-16(14(13)18)17-11(2)7-5-8-12(17)3/h11-13,15H,4-10H2,1-3H3
InChIKeyOPEDIAZVDMACHE-UHFFFAOYSA-N
XLogP1.76
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one (CID 83023930) is 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one is CCNC1CCCN(N2C(C)CCCC2C)C1=O.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one?
The InChIKey is OPEDIAZVDMACHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-4-15-13-9-6-10-16(14(13)18)17-11(2)7-5-8-12(17)3/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one?
1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one has a molecular weight of 253.39 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one is sourced from PubChem (CID 83023930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).