5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine

C14H18N2O3S — CID 116812467

IUPAC5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCOCCNc1ncc(-c2cccc(OC)c2OC)s1
InChIInChI=1S/C14H18N2O3S/c1-17-8-7-15-14-16-9-12(20-14)10-5-4-6-11(18-2)13(10)19-3/h4-6,9H,7-8H2,1-3H3,(H,15,16)
InChIKeyMUETZMFBZATSBU-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.89
Rot. Bonds7

About 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine

5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine (PubChem CID 116812467) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
PubChem CID116812467
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCOCCNc1ncc(-c2cccc(OC)c2OC)s1
InChIInChI=1S/C14H18N2O3S/c1-17-8-7-15-14-16-9-12(20-14)10-5-4-6-11(18-2)13(10)19-3/h4-6,9H,7-8H2,1-3H3,(H,15,16)
InChIKeyMUETZMFBZATSBU-UHFFFAOYSA-N
XLogP2.89
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

5-(2,3-dimethoxyphenyl)-N-methyl-1,3-thiazol-2-amine
CID 116811899
N-(2-methoxyethyl)-5-quinolin-8-yl-1,3-thiazol-2-amine
CID 116812463
5-(3-cyclopropylphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 116812420
N-(2-methoxyethyl)-5-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 116812397
5-(2-ethoxyphenyl)-N-propyl-1,3-thiazol-2-amine
CID 116812124
2-(3,4-dimethoxyphenyl)-N-[[5-(2,3-dimethoxyphenyl)-1,3-thiazol-2-yl]methyl]ethanamine
CID 53272089
5-(2-chloro-3,4-dimethoxyphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 116812252
3-[2-(2-methoxyethylamino)-1,3-thiazol-5-yl]benzonitrile
CID 116812492
2-(3-chlorophenyl)-N-[[5-(2,3-dimethoxyphenyl)-1,3-thiazol-2-yl]methyl]ethanamine
CID 53272031
5-(3-chloro-4-fluorophenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 116812431
N-(2-methoxyethyl)-5-(2-propylpyrazol-3-yl)-1,3-thiazol-2-amine
CID 114558347
5-butan-2-yl-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 116812434

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine (CID 116812467) is 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine is COCCNc1ncc(-c2cccc(OC)c2OC)s1.
What is the InChIKey of 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The InChIKey is MUETZMFBZATSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-17-8-7-15-14-16-9-12(20-14)10-5-4-6-11(18-2)13(10)19-3/h4-6,9H,7-8H2,1-3H3,(H,15,16).
What are the key properties of 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine has a molecular weight of 294.38 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dimethoxyphenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 116812467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).