(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone

C12H23N3O — CID 63103466

IUPAC(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone
SMILESCC1CCN(C(=O)C2CNCCN2)C(C)C1
InChIInChI=1S/C12H23N3O/c1-9-3-6-15(10(2)7-9)12(16)11-8-13-4-5-14-11/h9-11,13-14H,3-8H2,1-2H3
InChIKeyIHQSPKDHSDQWAU-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.19
Rot. Bonds1

About (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone

(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone (PubChem CID 63103466) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone.

Molecular Properties

Compound Name(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone
PubChem CID63103466
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone
SMILESCC1CCN(C(=O)C2CNCCN2)C(C)C1
InChIInChI=1S/C12H23N3O/c1-9-3-6-15(10(2)7-9)12(16)11-8-13-4-5-14-11/h9-11,13-14H,3-8H2,1-2H3
InChIKeyIHQSPKDHSDQWAU-UHFFFAOYSA-N
XLogP0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,4-dimethylpiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 62331219
(2,4-dimethylpiperidin-1-yl)-(4-hydroxypyrrolidin-2-yl)methanone
CID 62332502
(2,4-dimethylpiperidin-1-yl)-[(3S)-piperidin-3-yl]methanone
CID 81139161
(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-piperazin-2-ylmethanone
CID 102883594
(3-methylpiperidin-1-yl)-piperazin-2-ylmethanone
CID 63102910
(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone
CID 63103811
(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone
CID 63103464
[2-(hydroxymethyl)pyrrolidin-1-yl]-piperazin-2-ylmethanone
CID 63103994
azocan-1-yl(piperazin-2-yl)methanone
CID 63104167
4-methyl-1-[(2R)-piperidine-2-carbonyl]piperidine-2-carboxylic acid
CID 104921848
(5-ethyl-2-methylmorpholin-4-yl)-piperazin-2-ylmethanone
CID 63104526
2-methyl-1-(morpholine-3-carbonyl)piperidine-4-carboxylic acid
CID 106742878

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone?
The IUPAC name of (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone (CID 63103466) is (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone.
What is the SMILES notation for (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone?
The canonical SMILES for (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone is CC1CCN(C(=O)C2CNCCN2)C(C)C1.
What is the InChIKey of (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone?
The InChIKey is IHQSPKDHSDQWAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-9-3-6-15(10(2)7-9)12(16)11-8-13-4-5-14-11/h9-11,13-14H,3-8H2,1-2H3.
What are the key properties of (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone?
(2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone has a molecular weight of 225.34 g/mol, XLogP of 0.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylpiperidin-1-yl)-piperazin-2-ylmethanone is sourced from PubChem (CID 63103466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).