2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone

C15H29N3O — CID 64980735

IUPAC2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
SMILESCC1CC(C)CN(C(=O)CN2CC(C)NCC2C)C1
InChIInChI=1S/C15H29N3O/c1-11-5-12(2)8-18(7-11)15(19)10-17-9-13(3)16-6-14(17)4/h11-14,16H,5-10H2,1-4H3
InChIKeyUHXDNPCDYINOHF-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.17
Rot. Bonds2

About 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone

2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone (PubChem CID 64980735) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
PubChem CID64980735
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
SMILESCC1CC(C)CN(C(=O)CN2CC(C)NCC2C)C1
InChIInChI=1S/C15H29N3O/c1-11-5-12(2)8-18(7-11)15(19)10-17-9-13(3)16-6-14(17)4/h11-14,16H,5-10H2,1-4H3
InChIKeyUHXDNPCDYINOHF-UHFFFAOYSA-N
XLogP1.17
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-diethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 64979180
2-(2,5-dimethylpiperazin-1-yl)-N-ethyl-N-methylacetamide
CID 64980824
2-(2,5-dimethylpiperazin-1-yl)-N-propan-2-ylacetamide
CID 64980506
2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 64980306
N-(2-acetamidoethyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
CID 64980464
2-(2,5-dimethylpiperazin-1-yl)-N-prop-2-ynylacetamide
CID 64980630
N-(2-cyanoethyl)-2-(2,5-dimethylpiperazin-1-yl)-N-methylacetamide
CID 64980524
2-(2,5-dimethylpiperazin-1-yl)-N-(5-methylhexan-2-yl)acetamide
CID 64980257
3-[(2S,5R)-2,5-dimethylpiperazin-1-yl]-2,2-dimethylpropanoic acid
CID 164888568
1-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-5-[(3R,5R)-3,5-dimethylpiperidin-1-yl]pentane-1,5-dione
CID 896367
2-amino-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 24697792
1-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-3-methylpiperidine-2-carboxylic acid
CID 107072460

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone (CID 64980735) is 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone is CC1CC(C)CN(C(=O)CN2CC(C)NCC2C)C1.
What is the InChIKey of 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone?
The InChIKey is UHXDNPCDYINOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-11-5-12(2)8-18(7-11)15(19)10-17-9-13(3)16-6-14(17)4/h11-14,16H,5-10H2,1-4H3.
What are the key properties of 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone?
2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone has a molecular weight of 267.42 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone is sourced from PubChem (CID 64980735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).