4-methoxy-1,2-di(propan-2-yl)piperidine

C12H25NO — CID 175613620

IUPAC4-methoxy-1,2-di(propan-2-yl)piperidine
SMILESCOC1CCN(C(C)C)C(C(C)C)C1
InChIInChI=1S/C12H25NO/c1-9(2)12-8-11(14-5)6-7-13(12)10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyRPFSYNAQKYLTKD-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.53
Rot. Bonds3

About 4-methoxy-1,2-di(propan-2-yl)piperidine

4-methoxy-1,2-di(propan-2-yl)piperidine (PubChem CID 175613620) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-methoxy-1,2-di(propan-2-yl)piperidine.

Molecular Properties

Compound Name4-methoxy-1,2-di(propan-2-yl)piperidine
PubChem CID175613620
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name4-methoxy-1,2-di(propan-2-yl)piperidine
SMILESCOC1CCN(C(C)C)C(C(C)C)C1
InChIInChI=1S/C12H25NO/c1-9(2)12-8-11(14-5)6-7-13(12)10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyRPFSYNAQKYLTKD-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

4-methyl-1,2-di(propan-2-yl)piperidine
CID 141078246
(2S,4S)-4-cyclopropyloxy-1,2-di(propan-2-yl)pyrrolidine
CID 59610611
5-(1-fluoroethoxy)-1,2-di(propan-2-yl)azepane
CID 175612309
1,2,5-tri(propan-2-yl)azepane
CID 176801550
(2S)-1,2-di(propan-2-yl)pyrrolidine
CID 59966007
(2R)-1,2-di(propan-2-yl)pyrrolidine
CID 59965991
4-methyl-1,2-di(propan-2-yl)piperazine
CID 58964341
1,2-di(propan-2-yl)azocane
CID 134605032
[4-methoxy-1-(1-methoxybutan-2-yl)piperidin-2-yl]methanamine
CID 112622134
1-fluoro-4-methoxypiperidine
CID 154266449
cis-(1S,3R)-1,3-dimethoxycyclopentane
CID 22214084
ethane;3-methoxy-1-methylpyrrolidine;propan-2-ol
CID 168976522

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1,2-di(propan-2-yl)piperidine?
The IUPAC name of 4-methoxy-1,2-di(propan-2-yl)piperidine (CID 175613620) is 4-methoxy-1,2-di(propan-2-yl)piperidine.
What is the SMILES notation for 4-methoxy-1,2-di(propan-2-yl)piperidine?
The canonical SMILES for 4-methoxy-1,2-di(propan-2-yl)piperidine is COC1CCN(C(C)C)C(C(C)C)C1.
What is the InChIKey of 4-methoxy-1,2-di(propan-2-yl)piperidine?
The InChIKey is RPFSYNAQKYLTKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-9(2)12-8-11(14-5)6-7-13(12)10(3)4/h9-12H,6-8H2,1-5H3.
What are the key properties of 4-methoxy-1,2-di(propan-2-yl)piperidine?
4-methoxy-1,2-di(propan-2-yl)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-methoxy-1,2-di(propan-2-yl)piperidine is sourced from PubChem (CID 175613620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).