4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine

C12H25NO — CID 59691701

IUPAC4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
SMILESCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C12H25NO/c1-11-5-7-13(8-6-11)9-10-14-12(2,3)4/h11H,5-10H2,1-4H3
InChIKeyBKBGLUIDTIRXEH-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.53
Rot. Bonds3

About 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine

4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine (PubChem CID 59691701) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine.

Molecular Properties

Compound Name4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
PubChem CID59691701
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
SMILESCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C12H25NO/c1-11-5-7-13(8-6-11)9-10-14-12(2,3)4/h11H,5-10H2,1-4H3
InChIKeyBKBGLUIDTIRXEH-UHFFFAOYSA-N
XLogP2.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylpiperidin-1-yl)ethoxymethanetriamine
CID 71080676
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-piperidin-1-ylpiperidine
CID 56822093
3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
CID 114502590
(3R)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine
CID 103939668
3-bromo-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine
CID 112591814
4-(2-chloroethoxy)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 112591845
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine
CID 172511697
2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]oxyacetic acid
CID 112590618
N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605264
2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]ethanamine
CID 114802641
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-(2-propan-2-yloxyethyl)piperazine
CID 135217006
2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine
CID 39237896

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The IUPAC name of 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine (CID 59691701) is 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine.
What is the SMILES notation for 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The canonical SMILES for 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine is CC1CCN(CCOC(C)(C)C)CC1.
What is the InChIKey of 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The InChIKey is BKBGLUIDTIRXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-11-5-7-13(8-6-11)9-10-14-12(2,3)4/h11H,5-10H2,1-4H3.
What are the key properties of 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine has a molecular weight of 199.34 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine is sourced from PubChem (CID 59691701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).