4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine

C14H29NO — CID 142824881

IUPAC4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine
SMILESCCCC1(C)CCN(CCOC(C)C)CC1
InChIInChI=1S/C14H29NO/c1-5-6-14(4)7-9-15(10-8-14)11-12-16-13(2)3/h13H,5-12H2,1-4H3
InChIKeyOBYFHOQEKKMAPE-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.31
Rot. Bonds6

About 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine

4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine (PubChem CID 142824881) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine.

Molecular Properties

Compound Name4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine
PubChem CID142824881
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine
SMILESCCCC1(C)CCN(CCOC(C)C)CC1
InChIInChI=1S/C14H29NO/c1-5-6-14(4)7-9-15(10-8-14)11-12-16-13(2)3/h13H,5-12H2,1-4H3
InChIKeyOBYFHOQEKKMAPE-UHFFFAOYSA-N
XLogP3.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine?
The IUPAC name of 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine (CID 142824881) is 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine.
What is the SMILES notation for 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine?
The canonical SMILES for 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine is CCCC1(C)CCN(CCOC(C)C)CC1.
What is the InChIKey of 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine?
The InChIKey is OBYFHOQEKKMAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-5-6-14(4)7-9-15(10-8-14)11-12-16-13(2)3/h13H,5-12H2,1-4H3.
What are the key properties of 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine?
4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine has a molecular weight of 227.39 g/mol, XLogP of 3.31, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-propan-2-yloxyethyl)-4-propylpiperidine is sourced from PubChem (CID 142824881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).