2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole

C14H15NOS — CID 58689212

IUPAC2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1csc(-c2ccc3c(c2)CCO3)n1
InChIInChI=1S/C14H15NOS/c1-9(2)12-8-17-14(15-12)11-3-4-13-10(7-11)5-6-16-13/h3-4,7-9H,5-6H2,1-2H3
InChIKeyFKAAJNXYYVZUMW-UHFFFAOYSA-N
MW245.35 g/mol
LogP3.87
Rot. Bonds2

About 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole

2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole (PubChem CID 58689212) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole
PubChem CID58689212
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC Name2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1csc(-c2ccc3c(c2)CCO3)n1
InChIInChI=1S/C14H15NOS/c1-9(2)12-8-17-14(15-12)11-3-4-13-10(7-11)5-6-16-13/h3-4,7-9H,5-6H2,1-2H3
InChIKeyFKAAJNXYYVZUMW-UHFFFAOYSA-N
XLogP3.87
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole 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-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]propan-2-ol
CID 116890568
2-(3,4-dihydro-2H-chromen-6-yl)-4-methyl-1,3-thiazole
CID 116891920
2-(3,4-dihydro-2H-chromen-6-yl)-1,3-thiazol-4-ol
CID 116889808
2-(2,3-dihydro-1-benzofuran-5-yl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91013706
methyl 3-[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]propanoate
CID 100677303
4-(2,3-dihydro-1-benzofuran-5-yl)-2-methoxy-1,3-thiazole
CID 116967801
1-[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-5-yl]-N-methylethanamine
CID 62653372
2-(3-chloro-4-methylphenyl)-4-propan-2-yl-1,3-thiazole
CID 165458129
2-[2-(3,4-dihydro-2H-chromen-6-yl)-1,3-thiazol-4-yl]acetic acid
CID 98019181
methyl 2-[[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-4-carbonyl]amino]-1,3-thiazole-4-carboxylate
CID 121339129
2-(4-iodophenyl)-4-propan-2-yl-1,3-thiazole
CID 21355336
2-(4-fluorophenyl)-4-propan-2-yl-1,3-thiazole
CID 20664385

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole (CID 58689212) is 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole is CC(C)c1csc(-c2ccc3c(c2)CCO3)n1.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole?
The InChIKey is FKAAJNXYYVZUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c1-9(2)12-8-17-14(15-12)11-3-4-13-10(7-11)5-6-16-13/h3-4,7-9H,5-6H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole?
2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole has a molecular weight of 245.35 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 58689212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).