2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol

C12H15NO3S — CID 82441357

IUPAC2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol
SMILESCOCc1nc(-c2ccco2)sc1C(C)(C)O
InChIInChI=1S/C12H15NO3S/c1-12(2,14)10-8(7-15-3)13-11(17-10)9-5-4-6-16-9/h4-6,14H,7H2,1-3H3
InChIKeyNFLXWPMSIRFBBO-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.78
Rot. Bonds4

About 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol

2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol (PubChem CID 82441357) has the molecular formula C12H15NO3S and a molecular weight of 253.32 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol
PubChem CID82441357
Molecular FormulaC12H15NO3S
Molecular Weight253.32 g/mol
Exact Mass253.08
IUPAC Name2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol
SMILESCOCc1nc(-c2ccco2)sc1C(C)(C)O
InChIInChI=1S/C12H15NO3S/c1-12(2,14)10-8(7-15-3)13-11(17-10)9-5-4-6-16-9/h4-6,14H,7H2,1-3H3
InChIKeyNFLXWPMSIRFBBO-UHFFFAOYSA-N
XLogP2.78
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(furan-2-yl)-4-propan-2-yl-1,3-thiazol-5-yl]propan-2-ol
CID 82435103
N-[[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methyl]butan-2-amine
CID 82441346
2-[4-(methoxymethyl)-2-propan-2-yl-1,3-thiazol-5-yl]propan-2-ol
CID 82439989
2-[4-(methoxymethyl)-2-phenyl-1,3-thiazol-5-yl]propan-2-amine
CID 82440030
[4-tert-butyl-2-(furan-2-yl)-1,3-thiazol-5-yl]methanol
CID 82439271
2-[2-(3-methoxyphenyl)-4-propyl-1,3-thiazol-5-yl]propan-2-ol
CID 82432624
N-[[4-ethyl-2-(furan-2-yl)-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 113459709
[4-tert-butyl-2-(furan-2-yl)-1,3-thiazol-5-yl]methanamine
CID 82439289
4-tert-butyl-2-(furan-2-yl)-1,3-thiazole-5-carbohydrazide
CID 82439300
2-(furan-2-yl)-N-(2-methoxyethoxy)-5-methyl-1,3-thiazole-4-carboxamide
CID 79676397
5-(furan-2-yl)-2-(1-methylpyrrol-2-yl)-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 166805678
1-[2-(furan-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-methylmethanamine
CID 64718148

Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol?
The IUPAC name of 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol (CID 82441357) is 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol.
What is the SMILES notation for 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol?
The canonical SMILES for 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol is COCc1nc(-c2ccco2)sc1C(C)(C)O.
What is the InChIKey of 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol?
The InChIKey is NFLXWPMSIRFBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3S/c1-12(2,14)10-8(7-15-3)13-11(17-10)9-5-4-6-16-9/h4-6,14H,7H2,1-3H3.
What are the key properties of 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol?
2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol has a molecular weight of 253.32 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]propan-2-ol is sourced from PubChem (CID 82441357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).