3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine

C16H25NO3 — CID 18730019

IUPAC3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine
SMILESCCOC1CN(C)CC(OC)C1c1ccc(OC)cc1
InChIInChI=1S/C16H25NO3/c1-5-20-15-11-17(2)10-14(19-4)16(15)12-6-8-13(18-3)9-7-12/h6-9,14-16H,5,10-11H2,1-4H3
InChIKeyDDMUJBDYRXUJAM-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.14
Rot. Bonds5

About 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine

3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine (PubChem CID 18730019) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine.

Molecular Properties

Compound Name3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine
PubChem CID18730019
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine
SMILESCCOC1CN(C)CC(OC)C1c1ccc(OC)cc1
InChIInChI=1S/C16H25NO3/c1-5-20-15-11-17(2)10-14(19-4)16(15)12-6-8-13(18-3)9-7-12/h6-9,14-16H,5,10-11H2,1-4H3
InChIKeyDDMUJBDYRXUJAM-UHFFFAOYSA-N
XLogP2.14
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine?
The IUPAC name of 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine (CID 18730019) is 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine.
What is the SMILES notation for 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine?
The canonical SMILES for 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine is CCOC1CN(C)CC(OC)C1c1ccc(OC)cc1.
What is the InChIKey of 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine?
The InChIKey is DDMUJBDYRXUJAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-5-20-15-11-17(2)10-14(19-4)16(15)12-6-8-13(18-3)9-7-12/h6-9,14-16H,5,10-11H2,1-4H3.
What are the key properties of 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine?
3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine has a molecular weight of 279.38 g/mol, XLogP of 2.14, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-methoxy-4-(4-methoxyphenyl)-1-methylpiperidine is sourced from PubChem (CID 18730019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).