1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one

C14H27N3O — CID 114506080

IUPAC1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one
SMILESCCNC1CCCN(C2CCN(C)CC2C)C1=O
InChIInChI=1S/C14H27N3O/c1-4-15-12-6-5-8-17(14(12)18)13-7-9-16(3)10-11(13)2/h11-13,15H,4-10H2,1-3H3
InChIKeyZWVHETFGVJEVMG-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.93
Rot. Bonds3

About 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one

1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one (PubChem CID 114506080) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one.

Molecular Properties

Compound Name1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one
PubChem CID114506080
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one
SMILESCCNC1CCCN(C2CCN(C)CC2C)C1=O
InChIInChI=1S/C14H27N3O/c1-4-15-12-6-5-8-17(14(12)18)13-7-9-16(3)10-11(13)2/h11-13,15H,4-10H2,1-3H3
InChIKeyZWVHETFGVJEVMG-UHFFFAOYSA-N
XLogP0.93
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 ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-dimethylpiperidin-4-yl)-3-(methylamino)pyrrolidin-2-one
CID 114504246
1-(2,3-dihydro-1H-inden-2-yl)-3-(ethylamino)piperidin-2-one
CID 107849751
1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)piperidin-2-one
CID 83023930
3-(ethylamino)-1-(1-ethylpiperidin-3-yl)pyrrolidin-2-one
CID 54972827
1-(1,3-dimethylpiperidin-4-yl)pyrrolidine-2,4-dione
CID 114504190
3-(ethylamino)-1-(2-methyloxolan-3-yl)pyrrolidin-2-one
CID 82728265
3-(ethylamino)-1-(2-methoxycyclopentyl)pyrrolidin-2-one
CID 62086274
1-(1,1-dioxothian-4-yl)-3-(ethylamino)pyrrolidin-2-one
CID 54972965
(2R)-1-[(3R,4S)-1,3-dimethylpiperidin-4-yl]pyrrolidine-2-carboxylic acid
CID 51980118
3-(1,3-dimethylpiperidin-4-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 114507163
1-(1,3-dimethylpiperidin-4-yl)-3-ethyl-3-methylpiperazine-2,5-dione
CID 114506205
1-(2,5-difluoro-4-methylphenyl)-3-(ethylamino)piperidin-2-one
CID 103587567

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one?
The IUPAC name of 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one (CID 114506080) is 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one.
What is the SMILES notation for 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one?
The canonical SMILES for 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one is CCNC1CCCN(C2CCN(C)CC2C)C1=O.
What is the InChIKey of 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one?
The InChIKey is ZWVHETFGVJEVMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-4-15-12-6-5-8-17(14(12)18)13-7-9-16(3)10-11(13)2/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one?
1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one has a molecular weight of 253.39 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpiperidin-4-yl)-3-(ethylamino)piperidin-2-one is sourced from PubChem (CID 114506080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).