3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one

C15H27N3O2 — CID 63600542

IUPAC3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one
SMILESCCCC1(C(=O)N2CCNC(=O)C2CC)CCCNC1
InChIInChI=1S/C15H27N3O2/c1-3-6-15(7-5-8-16-11-15)14(20)18-10-9-17-13(19)12(18)4-2/h12,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyYUOSTPLWSQAOGI-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.89
Rot. Bonds4

About 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one

3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one (PubChem CID 63600542) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one
PubChem CID63600542
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one
SMILESCCCC1(C(=O)N2CCNC(=O)C2CC)CCCNC1
InChIInChI=1S/C15H27N3O2/c1-3-6-15(7-5-8-16-11-15)14(20)18-10-9-17-13(19)12(18)4-2/h12,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyYUOSTPLWSQAOGI-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl-(3-propylpiperidin-3-yl)methanone
CID 63135439
(4,4-diethylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63163762
(3,5-dimethylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132443
(4-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132180
(3-hydroxy-3-methylpyrrolidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 103355905
(1,1-dioxo-1,4-thiazinan-4-yl)-(3-propylpiperidin-3-yl)methanone
CID 55164111
(2,2-dimethylpyrrolidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63217718
(4R)-3-(3-propylpiperidine-3-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 63132013
4-(3-propylpiperidine-3-carbonyl)morpholine-3-carboxamide
CID 83102514
(3-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63130056
3-ethyl-4-(1-phenylcyclopropanecarbonyl)piperazin-2-one
CID 63600480
2-[4-(3-propylpiperidine-3-carbonyl)thiomorpholin-3-yl]acetic acid
CID 66444964

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one?
The IUPAC name of 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one (CID 63600542) is 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one.
What is the SMILES notation for 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one?
The canonical SMILES for 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one is CCCC1(C(=O)N2CCNC(=O)C2CC)CCCNC1.
What is the InChIKey of 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one?
The InChIKey is YUOSTPLWSQAOGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-3-6-15(7-5-8-16-11-15)14(20)18-10-9-17-13(19)12(18)4-2/h12,16H,3-11H2,1-2H3,(H,17,19).
What are the key properties of 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one?
3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one has a molecular weight of 281.40 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(3-propylpiperidine-3-carbonyl)piperazin-2-one is sourced from PubChem (CID 63600542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).