3,5-dimethyl-2-propan-2-ylpiperidine;ethane

C16H39N — CID 176942573

IUPAC3,5-dimethyl-2-propan-2-ylpiperidine;ethane
SMILESCC.CC.CC.CC1CNC(C(C)C)C(C)C1
InChIInChI=1S/C10H21N.3C2H6/c1-7(2)10-9(4)5-8(3)6-11-10;3*1-2/h7-11H,5-6H2,1-4H3;3*1-2H3
InChIKeyRVCFMZITKSTIOY-UHFFFAOYSA-N
MW245.49 g/mol
LogP5.36
Rot. Bonds1

About 3,5-dimethyl-2-propan-2-ylpiperidine;ethane

3,5-dimethyl-2-propan-2-ylpiperidine;ethane (PubChem CID 176942573) has the molecular formula C16H39N and a molecular weight of 245.49 g/mol. Its IUPAC name is 3,5-dimethyl-2-propan-2-ylpiperidine;ethane.

Molecular Properties

Compound Name3,5-dimethyl-2-propan-2-ylpiperidine;ethane
PubChem CID176942573
Molecular FormulaC16H39N
Molecular Weight245.49 g/mol
Exact Mass245.31
IUPAC Name3,5-dimethyl-2-propan-2-ylpiperidine;ethane
SMILESCC.CC.CC.CC1CNC(C(C)C)C(C)C1
InChIInChI=1S/C10H21N.3C2H6/c1-7(2)10-9(4)5-8(3)6-11-10;3*1-2/h7-11H,5-6H2,1-4H3;3*1-2H3
InChIKeyRVCFMZITKSTIOY-UHFFFAOYSA-N
XLogP5.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500245.49
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3,5-dimethyl-2-propan-2-ylpiperidine;ethane 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-methyl-1-[(2S,4R)-4-methylpyrrolidin-2-yl]propan-1-ol
CID 101194744
4,5-dimethyl-2-propan-2-ylpiperidine
CID 59968909
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
1,4-dimethyl-2-propan-2-ylcyclopentane
CID 91513076
2-methyl-1-(4-methylpyrrolidin-2-yl)propan-1-one
CID 90895243
3,5-dimethylpiperidine-2-carboxamide
CID 173167928
(2S,5R)-5-methyl-2-propan-2-ylpiperidine;hydrochloride
CID 170903987
2-chloro-5-methylpiperidin-3-ol
CID 176943303
ethane;4-methyl-2-phenylpyrrolidine
CID 142973679
ethane;4-methyl-2-propylpyrrolidine
CID 170743275
2-(3,3-dimethylbutyl)-3,5-dimethylpiperidine
CID 130816302
N,N-dimethyl-1-(4-methylpyrrolidin-2-yl)methanamine;ethane
CID 168883366

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-propan-2-ylpiperidine;ethane?
The IUPAC name of 3,5-dimethyl-2-propan-2-ylpiperidine;ethane (CID 176942573) is 3,5-dimethyl-2-propan-2-ylpiperidine;ethane.
What is the SMILES notation for 3,5-dimethyl-2-propan-2-ylpiperidine;ethane?
The canonical SMILES for 3,5-dimethyl-2-propan-2-ylpiperidine;ethane is CC.CC.CC.CC1CNC(C(C)C)C(C)C1.
What is the InChIKey of 3,5-dimethyl-2-propan-2-ylpiperidine;ethane?
The InChIKey is RVCFMZITKSTIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N.3C2H6/c1-7(2)10-9(4)5-8(3)6-11-10;3*1-2/h7-11H,5-6H2,1-4H3;3*1-2H3.
What are the key properties of 3,5-dimethyl-2-propan-2-ylpiperidine;ethane?
3,5-dimethyl-2-propan-2-ylpiperidine;ethane has a molecular weight of 245.49 g/mol, XLogP of 5.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-propan-2-ylpiperidine;ethane is sourced from PubChem (CID 176942573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).