3-(methoxymethyl)-1-(1-phenylethyl)piperidine

C15H23NO — CID 56764597

IUPAC3-(methoxymethyl)-1-(1-phenylethyl)piperidine
SMILESCOCC1CCCN(C(C)c2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-13(15-8-4-3-5-9-15)16-10-6-7-14(11-16)12-17-2/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3
InChIKeyXLWOERYXXMUKRC-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.11
Rot. Bonds4

About 3-(methoxymethyl)-1-(1-phenylethyl)piperidine

3-(methoxymethyl)-1-(1-phenylethyl)piperidine (PubChem CID 56764597) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-(1-phenylethyl)piperidine.

Molecular Properties

Compound Name3-(methoxymethyl)-1-(1-phenylethyl)piperidine
PubChem CID56764597
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name3-(methoxymethyl)-1-(1-phenylethyl)piperidine
SMILESCOCC1CCCN(C(C)c2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-13(15-8-4-3-5-9-15)16-10-6-7-14(11-16)12-17-2/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3
InChIKeyXLWOERYXXMUKRC-UHFFFAOYSA-N
XLogP3.11
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-Benzyl-1-oxa-6-azaspiro(2,5)octane
CID 89238
(1-Benzylpiperidin-4-yl)methanol
CID 736802
4-Propyl-1-[3-(phenylpropoxy)propyl]piperidine
CID 44563683
4-Butyl-1-[3-(phenylpropoxy)propyl]piperidine
CID 44563684
(1-Benzylpiperidin-3-yl)methanol
CID 10398044
(R)-1-benzyl-2-((R)-2-methoxy-1-phenylethyl)piperidine
CID 16719672
2-[(2S)-1-benzyl-4-(3-methylbutyl)piperazin-2-yl]ethanol
CID 90655534
1-Benzyl-2,5-dimethylpiperidin-4-ol
CID 3104852
1-Methyl-2-phenylpiperidine
CID 98434
4-Methyl-1-(1-phenylpropyl)piperidine--hydrogen chloride (1/1)
CID 3056522
1-(2-Methyl-1-phenylpropyl)piperidine--hydrogen chloride (1/1)
CID 3056525
4-(1-Phenylbutyl)morpholine--hydrogen chloride (1/1)
CID 3057372

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-(1-phenylethyl)piperidine?
The IUPAC name of 3-(methoxymethyl)-1-(1-phenylethyl)piperidine (CID 56764597) is 3-(methoxymethyl)-1-(1-phenylethyl)piperidine.
What is the SMILES notation for 3-(methoxymethyl)-1-(1-phenylethyl)piperidine?
The canonical SMILES for 3-(methoxymethyl)-1-(1-phenylethyl)piperidine is COCC1CCCN(C(C)c2ccccc2)C1.
What is the InChIKey of 3-(methoxymethyl)-1-(1-phenylethyl)piperidine?
The InChIKey is XLWOERYXXMUKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-13(15-8-4-3-5-9-15)16-10-6-7-14(11-16)12-17-2/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-1-(1-phenylethyl)piperidine?
3-(methoxymethyl)-1-(1-phenylethyl)piperidine has a molecular weight of 233.36 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-(1-phenylethyl)piperidine is sourced from PubChem (CID 56764597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).