2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine

C15H20N2O2S — CID 62071611

IUPAC2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine
SMILESCOCCNC(c1ccc(OC)cc1)c1nc(C)cs1
InChIInChI=1S/C15H20N2O2S/c1-11-10-20-15(17-11)14(16-8-9-18-2)12-4-6-13(19-3)7-5-12/h4-7,10,14,16H,8-9H2,1-3H3
InChIKeyNCOZICPGNSEKFA-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.79
Rot. Bonds7

About 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine

2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine (PubChem CID 62071611) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine
PubChem CID62071611
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine
SMILESCOCCNC(c1ccc(OC)cc1)c1nc(C)cs1
InChIInChI=1S/C15H20N2O2S/c1-11-10-20-15(17-11)14(16-8-9-18-2)12-4-6-13(19-3)7-5-12/h4-7,10,14,16H,8-9H2,1-3H3
InChIKeyNCOZICPGNSEKFA-UHFFFAOYSA-N
XLogP2.79
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine 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 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine (CID 62071611) is 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine is COCCNC(c1ccc(OC)cc1)c1nc(C)cs1.
What is the InChIKey of 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine?
The InChIKey is NCOZICPGNSEKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-11-10-20-15(17-11)14(16-8-9-18-2)12-4-6-13(19-3)7-5-12/h4-7,10,14,16H,8-9H2,1-3H3.
What are the key properties of 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine?
2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine has a molecular weight of 292.40 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(4-methoxyphenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]ethanamine is sourced from PubChem (CID 62071611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).