N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine

C15H14N2O2S — CID 86645041

IUPACN-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nccs2)cc1OCc1ccco1
InChIInChI=1S/C15H14N2O2S/c1-11-4-5-12(17-15-16-6-8-20-15)9-14(11)19-10-13-3-2-7-18-13/h2-9H,10H2,1H3,(H,16,17)
InChIKeyWZLJCYKDNJORSC-UHFFFAOYSA-N
MW286.36 g/mol
LogP4.37
Rot. Bonds5

About N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine

N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine (PubChem CID 86645041) has the molecular formula C15H14N2O2S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine
PubChem CID86645041
Molecular FormulaC15H14N2O2S
Molecular Weight286.36 g/mol
Exact Mass286.08
IUPAC NameN-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nccs2)cc1OCc1ccco1
InChIInChI=1S/C15H14N2O2S/c1-11-4-5-12(17-15-16-6-8-20-15)9-14(11)19-10-13-3-2-7-18-13/h2-9H,10H2,1H3,(H,16,17)
InChIKeyWZLJCYKDNJORSC-UHFFFAOYSA-N
XLogP4.37
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-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

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine (CID 86645041) is N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine is Cc1ccc(Nc2nccs2)cc1OCc1ccco1.
What is the InChIKey of N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine?
The InChIKey is WZLJCYKDNJORSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S/c1-11-4-5-12(17-15-16-6-8-20-15)9-14(11)19-10-13-3-2-7-18-13/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine?
N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine has a molecular weight of 286.36 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-ylmethoxy)-4-methylphenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 86645041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).