4-methoxy-1-(2-methylpentan-2-yl)piperidine

C12H25NO — CID 146178496

IUPAC4-methoxy-1-(2-methylpentan-2-yl)piperidine
SMILESCCCC(C)(C)N1CCC(OC)CC1
InChIInChI=1S/C12H25NO/c1-5-8-12(2,3)13-9-6-11(14-4)7-10-13/h11H,5-10H2,1-4H3
InChIKeyLLKUZXKGIPEVPL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.68
Rot. Bonds4

About 4-methoxy-1-(2-methylpentan-2-yl)piperidine

4-methoxy-1-(2-methylpentan-2-yl)piperidine (PubChem CID 146178496) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-methoxy-1-(2-methylpentan-2-yl)piperidine.

Molecular Properties

Compound Name4-methoxy-1-(2-methylpentan-2-yl)piperidine
PubChem CID146178496
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name4-methoxy-1-(2-methylpentan-2-yl)piperidine
SMILESCCCC(C)(C)N1CCC(OC)CC1
InChIInChI=1S/C12H25NO/c1-5-8-12(2,3)13-9-6-11(14-4)7-10-13/h11H,5-10H2,1-4H3
InChIKeyLLKUZXKGIPEVPL-UHFFFAOYSA-N
XLogP2.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-methylbutan-2-yl)-1-(2-methylpentan-2-yl)piperidine
CID 167228555
4-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylbutanoic acid
CID 115000019
2-(3-methoxypyrrolidin-1-yl)-2-methylheptan-1-amine
CID 103531540
3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
CID 62534739
1-(2-methylpentan-2-yl)-3-[(2-methylpropan-2-yl)oxy]azetidine
CID 134396152
1-(2-methylpentan-2-yl)-4-propylpiperazine
CID 170790911
1-[(3S)-1-tert-butylpyrrolidin-3-yl]-4-methoxypiperidine
CID 166567506
(3S)-1-(2-methylpentan-2-yl)piperidin-3-ol
CID 130272331
2-[(4-methoxypiperidin-1-yl)methyl]-2-methyl-N-(2-methylpropyl)pentan-1-amine
CID 62264057
4-methoxy-2-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-amine
CID 103531700
2-cyclopropyl-2-(4-methoxypiperidin-1-yl)propanoic acid
CID 82238527
N-ethyl-N'-[2-(4-methoxypiperidin-1-yl)-2-methylpropyl]-3-methylpiperidine-1-carboximidamide
CID 119155651

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(2-methylpentan-2-yl)piperidine?
The IUPAC name of 4-methoxy-1-(2-methylpentan-2-yl)piperidine (CID 146178496) is 4-methoxy-1-(2-methylpentan-2-yl)piperidine.
What is the SMILES notation for 4-methoxy-1-(2-methylpentan-2-yl)piperidine?
The canonical SMILES for 4-methoxy-1-(2-methylpentan-2-yl)piperidine is CCCC(C)(C)N1CCC(OC)CC1.
What is the InChIKey of 4-methoxy-1-(2-methylpentan-2-yl)piperidine?
The InChIKey is LLKUZXKGIPEVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-5-8-12(2,3)13-9-6-11(14-4)7-10-13/h11H,5-10H2,1-4H3.
What are the key properties of 4-methoxy-1-(2-methylpentan-2-yl)piperidine?
4-methoxy-1-(2-methylpentan-2-yl)piperidine has a molecular weight of 199.34 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(2-methylpentan-2-yl)piperidine is sourced from PubChem (CID 146178496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).