4-ethyl-2-(2-propoxyphenyl)piperidine

C16H25NO — CID 104662519

IUPAC4-ethyl-2-(2-propoxyphenyl)piperidine
SMILESCCCOc1ccccc1C1CC(CC)CCN1
InChIInChI=1S/C16H25NO/c1-3-11-18-16-8-6-5-7-14(16)15-12-13(4-2)9-10-17-15/h5-8,13,15,17H,3-4,9-12H2,1-2H3
InChIKeyAPFBFFVRQDMNOI-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.93
Rot. Bonds5

About 4-ethyl-2-(2-propoxyphenyl)piperidine

4-ethyl-2-(2-propoxyphenyl)piperidine (PubChem CID 104662519) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 4-ethyl-2-(2-propoxyphenyl)piperidine.

Molecular Properties

Compound Name4-ethyl-2-(2-propoxyphenyl)piperidine
PubChem CID104662519
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name4-ethyl-2-(2-propoxyphenyl)piperidine
SMILESCCCOc1ccccc1C1CC(CC)CCN1
InChIInChI=1S/C16H25NO/c1-3-11-18-16-8-6-5-7-14(16)15-12-13(4-2)9-10-17-15/h5-8,13,15,17H,3-4,9-12H2,1-2H3
InChIKeyAPFBFFVRQDMNOI-UHFFFAOYSA-N
XLogP3.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2-ethoxyphenyl)azetidine
CID 131015812
[2-(2-methoxyphenyl)piperidin-4-yl]methanol
CID 105477698
(2S)-4-ethyl-2-phenylpiperidine
CID 170718389
4-ethyl-N-(2-propoxyphenyl)piperidine-2-carboxamide
CID 114428199
2-methyl-5-(2-propoxyphenyl)piperidine
CID 104662635
2-[2-(2-methoxyethoxy)phenyl]piperidine
CID 104662497
3-[(2-propoxyphenoxy)methyl]pyrrolidine
CID 55064564
2-(2-ethoxyphenyl)piperidine;hydrochloride
CID 17389892
(2S)-2-(2-ethoxyphenyl)piperidine;hydrochloride
CID 171194884
1-[(1S)-2-(2-propoxyphenyl)cyclopropyl]ethanone
CID 43828941
1-bromo-3-(2-propoxyphenyl)cycloheptane
CID 104662860
N-methyl-3-(2-propoxyphenyl)cyclohexan-1-amine
CID 113438529

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(2-propoxyphenyl)piperidine?
The IUPAC name of 4-ethyl-2-(2-propoxyphenyl)piperidine (CID 104662519) is 4-ethyl-2-(2-propoxyphenyl)piperidine.
What is the SMILES notation for 4-ethyl-2-(2-propoxyphenyl)piperidine?
The canonical SMILES for 4-ethyl-2-(2-propoxyphenyl)piperidine is CCCOc1ccccc1C1CC(CC)CCN1.
What is the InChIKey of 4-ethyl-2-(2-propoxyphenyl)piperidine?
The InChIKey is APFBFFVRQDMNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-11-18-16-8-6-5-7-14(16)15-12-13(4-2)9-10-17-15/h5-8,13,15,17H,3-4,9-12H2,1-2H3.
What are the key properties of 4-ethyl-2-(2-propoxyphenyl)piperidine?
4-ethyl-2-(2-propoxyphenyl)piperidine has a molecular weight of 247.38 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(2-propoxyphenyl)piperidine is sourced from PubChem (CID 104662519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).