1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine

C13H27NO — CID 123491134

IUPAC1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine
SMILESCOC(C)(C)CC(C)(C)N1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(2,11-13(3,4)15-5)14-9-7-6-8-10-14/h6-11H2,1-5H3
InChIKeyUIXCPGUDFIZKHE-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.07
Rot. Bonds4

About 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine

1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine (PubChem CID 123491134) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine.

Molecular Properties

Compound Name1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine
PubChem CID123491134
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine
SMILESCOC(C)(C)CC(C)(C)N1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(2,11-13(3,4)15-5)14-9-7-6-8-10-14/h6-11H2,1-5H3
InChIKeyUIXCPGUDFIZKHE-UHFFFAOYSA-N
XLogP3.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,6R)-2,3,4,4,6-pentamethyl-1,3-oxazinane
CID 21723187
4-Methoxy-1,4-dimethylpiperidine
CID 13802894
1-Ethyl-4-methoxy-4-methylpiperidine
CID 13802895
4-Methoxy-1-methyl-4-propylpiperidine
CID 13802896
Piperidine, 4-methoxy-1-methyl-4-(1-methylethyl)-(9CI)
CID 13802897
4-Methoxy-2,2,6,6-tetramethyl-1-(2-methylpropyl)piperidine
CID 18715871
4-Methoxy-2,2,6,6-tetramethyl-1-propylpiperidine
CID 20768153
4-Ethyl-4-methoxy-1-methylpiperidine
CID 21050552
4-Methoxy-1,2,2,3-tetramethylpiperidine
CID 23161988
1-Tert-butyl-4-methoxy-4-methylpiperidine
CID 57559170
1-Tert-butyl-4-methoxypiperidine
CID 57643313
4-Methoxy-4-propan-2-yl-1-propylpiperidine
CID 58516681

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine?
The IUPAC name of 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine (CID 123491134) is 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine.
What is the SMILES notation for 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine?
The canonical SMILES for 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine is COC(C)(C)CC(C)(C)N1CCCCC1.
What is the InChIKey of 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine?
The InChIKey is UIXCPGUDFIZKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-12(2,11-13(3,4)15-5)14-9-7-6-8-10-14/h6-11H2,1-5H3.
What are the key properties of 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine?
1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine has a molecular weight of 213.36 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2,4-dimethylpentan-2-yl)piperidine is sourced from PubChem (CID 123491134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).