1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one

C15H29N3O — CID 80548544

IUPAC1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one
SMILESCCC1CCCN(C(=O)C(C)(C)N2CCNCC2)C1
InChIInChI=1S/C15H29N3O/c1-4-13-6-5-9-17(12-13)14(19)15(2,3)18-10-7-16-8-11-18/h13,16H,4-12H2,1-3H3
InChIKeyUZLCSORKPHGBKE-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.32
Rot. Bonds3

About 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one

1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one (PubChem CID 80548544) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one.

Molecular Properties

Compound Name1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one
PubChem CID80548544
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one
SMILESCCC1CCCN(C(=O)C(C)(C)N2CCNCC2)C1
InChIInChI=1S/C15H29N3O/c1-4-13-6-5-9-17(12-13)14(19)15(2,3)18-10-7-16-8-11-18/h13,16H,4-12H2,1-3H3
InChIKeyUZLCSORKPHGBKE-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethoxypiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one
CID 80550106
1-(3-ethylpiperidin-1-yl)-2,2,2-trifluoroethanone
CID 62490949
N-[1-(2-methyl-2-piperazin-1-ylpropanoyl)piperidin-3-yl]acetamide
CID 80547621
1-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one
CID 80549868
2-amino-1-[3-(hydroxymethyl)piperidin-1-yl]-2-methylpentan-1-one
CID 60848400
2-methyl-2-piperazin-1-yl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one
CID 103812458
1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62689348
cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone
CID 176933785
2-methyl-1-(2-methylthiomorpholin-4-yl)-2-piperazin-1-ylpropan-1-one
CID 115739169
methyl 1-(2-methyl-2-piperazin-1-ylpropanoyl)piperidine-4-carboxylate
CID 80547378
2-(4-aminophenyl)-1-(3-ethylpiperidin-1-yl)-2-methylpropan-1-one
CID 80556941
2-methyl-2-(4-methylpiperidin-1-yl)-1-piperazin-1-ylpropan-1-one
CID 39256559

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one?
The IUPAC name of 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one (CID 80548544) is 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one.
What is the SMILES notation for 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one?
The canonical SMILES for 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one is CCC1CCCN(C(=O)C(C)(C)N2CCNCC2)C1.
What is the InChIKey of 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one?
The InChIKey is UZLCSORKPHGBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-4-13-6-5-9-17(12-13)14(19)15(2,3)18-10-7-16-8-11-18/h13,16H,4-12H2,1-3H3.
What are the key properties of 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one?
1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one has a molecular weight of 267.42 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylpiperidin-1-yl)-2-methyl-2-piperazin-1-ylpropan-1-one is sourced from PubChem (CID 80548544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).