[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine

C14H18N2O2S — CID 82430343

IUPAC[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(-c2cc(OC)ccc2OC)sc1CN
InChIInChI=1S/C14H18N2O2S/c1-4-11-13(8-15)19-14(16-11)10-7-9(17-2)5-6-12(10)18-3/h5-7H,4,8,15H2,1-3H3
InChIKeyHYMWKAGVNORWID-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.85
Rot. Bonds5

About [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine

[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine (PubChem CID 82430343) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
PubChem CID82430343
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC Name[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
SMILESCCc1nc(-c2cc(OC)ccc2OC)sc1CN
InChIInChI=1S/C14H18N2O2S/c1-4-11-13(8-15)19-14(16-11)10-7-9(17-2)5-6-12(10)18-3/h5-7H,4,8,15H2,1-3H3
InChIKeyHYMWKAGVNORWID-UHFFFAOYSA-N
XLogP2.85
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine 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

[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanethiol
CID 82430342
[4-(2,5-dimethoxyphenyl)-2-methyl-1,3-thiazol-5-yl]methanamine
CID 28709843
[2-(2,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 82133642
2-[2-(2,5-dimethoxyphenyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]acetonitrile
CID 82441375
[4-bromo-2-(2,4-dimethoxyphenyl)-1,3-thiazol-5-yl]methanamine
CID 84608613
[4-ethyl-2-[(4-methoxyphenyl)methyl]-1,3-thiazol-5-yl]methanamine
CID 82428463
5-(aminomethyl)-4-ethyl-N-(3-methoxyphenyl)-N-methyl-1,3-thiazol-2-amine
CID 62766655
2-(2,5-dimethoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887517
[2-(2-bromophenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 112706350
[4-ethyl-2-(2-fluoro-5-methylphenyl)-1,3-thiazol-5-yl]methanamine
CID 107932019
[2-(4-chloro-2-fluorophenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 104840990
2-[2-(2,5-dimethoxyphenyl)-4-propan-2-yl-1,3-thiazol-5-yl]acetonitrile
CID 82435121

Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine (CID 82430343) is [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine is CCc1nc(-c2cc(OC)ccc2OC)sc1CN.
What is the InChIKey of [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
The InChIKey is HYMWKAGVNORWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-4-11-13(8-15)19-14(16-11)10-7-9(17-2)5-6-12(10)18-3/h5-7H,4,8,15H2,1-3H3.
What are the key properties of [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine?
[2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine has a molecular weight of 278.38 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dimethoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 82430343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).