(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride

C15H29ClN2O — CID 119311368

IUPAC(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride
SMILESCC(C)(C)C1CCN(C(=O)C2CCNCC2)CC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-15(2,3)13-6-10-17(11-7-13)14(18)12-4-8-16-9-5-12;/h12-13,16H,4-11H2,1-3H3;1H
InChIKeyAWZUZNXLYLUBQB-UHFFFAOYSA-N
MW288.86 g/mol
LogP2.69
Rot. Bonds1

About (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride

(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride (PubChem CID 119311368) has the molecular formula C15H29ClN2O and a molecular weight of 288.86 g/mol. Its IUPAC name is (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride
PubChem CID119311368
Molecular FormulaC15H29ClN2O
Molecular Weight288.86 g/mol
Exact Mass288.20
IUPAC Name(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride
SMILESCC(C)(C)C1CCN(C(=O)C2CCNCC2)CC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-15(2,3)13-6-10-17(11-7-13)14(18)12-4-8-16-9-5-12;/h12-13,16H,4-11H2,1-3H3;1H
InChIKeyAWZUZNXLYLUBQB-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.86
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride 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

(4-tert-butylazepan-1-yl)-pyrrolidin-3-ylmethanone;hydrochloride
CID 119787780
1-(4-tert-butylpiperidin-1-yl)-2-piperidin-4-ylethanone;hydrochloride
CID 119762687
(4-tert-butylpiperidin-1-yl)-(1-methylazetidin-3-yl)methanone
CID 171417283
piperidin-4-yl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103797757
(4-methylazepan-1-yl)-piperidin-4-ylmethanone;hydrochloride
CID 119307759
(4-tert-butylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 119311371
[4-(3-methylbutyl)piperidin-1-yl]-piperidin-4-ylmethanone;hydrochloride
CID 119345602
[(3S)-3-methylpyrrolidin-1-yl]-piperidin-4-ylmethanone
CID 90192135
ethane;(4-methylpiperazin-1-yl)-piperidin-4-ylmethanone
CID 176554643
[4-[(1R)-1-hydroxyethyl]piperidin-1-yl]-piperidin-4-ylmethanone
CID 129371132
(3-tert-butylazetidin-1-yl)-[(3S)-pyrrolidin-3-yl]methanone
CID 164785278
[4-(piperidine-4-carbonyl)piperazin-1-yl] 2,2-dimethylpropanoate
CID 175276230

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride?
The IUPAC name of (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride (CID 119311368) is (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride.
What is the SMILES notation for (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride?
The canonical SMILES for (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride is CC(C)(C)C1CCN(C(=O)C2CCNCC2)CC1.Cl.
What is the InChIKey of (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride?
The InChIKey is AWZUZNXLYLUBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O.ClH/c1-15(2,3)13-6-10-17(11-7-13)14(18)12-4-8-16-9-5-12;/h12-13,16H,4-11H2,1-3H3;1H.
What are the key properties of (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride?
(4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride has a molecular weight of 288.86 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylpiperidin-1-yl)-piperidin-4-ylmethanone;hydrochloride is sourced from PubChem (CID 119311368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).