(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone

C9H11NO3S — CID 126999981

IUPAC(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone
SMILESCOc1cc(C(=O)C2CCOC2)sn1
InChIInChI=1S/C9H11NO3S/c1-12-8-4-7(14-10-8)9(11)6-2-3-13-5-6/h4,6H,2-3,5H2,1H3
InChIKeyIPJPBYPLXCQVNA-UHFFFAOYSA-N
MW213.26 g/mol
LogP1.37
Rot. Bonds3

About (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone

(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone (PubChem CID 126999981) has the molecular formula C9H11NO3S and a molecular weight of 213.26 g/mol. Its IUPAC name is (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone
PubChem CID126999981
Molecular FormulaC9H11NO3S
Molecular Weight213.26 g/mol
Exact Mass213.05
IUPAC Name(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone
SMILESCOc1cc(C(=O)C2CCOC2)sn1
InChIInChI=1S/C9H11NO3S/c1-12-8-4-7(14-10-8)9(11)6-2-3-13-5-6/h4,6H,2-3,5H2,1H3
InChIKeyIPJPBYPLXCQVNA-UHFFFAOYSA-N
XLogP1.37
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone 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

(6-methoxy-3-pyridinyl)-(oxolan-3-yl)methanone
CID 130594889
(2-methoxy-1,3-thiazol-4-yl)-(oxolan-3-yl)methanone
CID 130571308
(3-methoxypyrazin-2-yl)-(oxolan-3-yl)methanone
CID 104514951
(6-methoxypyridazin-3-yl)-(oxan-3-yl)methanone
CID 107136044
N-(6-methoxypyridazin-3-yl)oxolane-3-carboxamide
CID 155503304
2-amino-1-(3-methoxy-1,2-thiazol-5-yl)propan-1-one
CID 127000407
(3-methyltriazol-4-yl)-(oxolan-3-yl)methanone
CID 114685879
(3R)-N-[3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-yl]oxolane-3-carboxamide
CID 95313237
(4-bromo-5-methylthiophen-2-yl)-(oxan-4-yl)methanone
CID 102826639
(3-iodophenyl)-(oxolan-3-yl)methanone
CID 114972035
[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 91627512
(2-methyltriazol-4-yl)-(oxolan-3-yl)methanone
CID 130521398

Frequently Asked Questions

What is the IUPAC name of (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone?
The IUPAC name of (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone (CID 126999981) is (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone.
What is the SMILES notation for (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone?
The canonical SMILES for (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone is COc1cc(C(=O)C2CCOC2)sn1.
What is the InChIKey of (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone?
The InChIKey is IPJPBYPLXCQVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO3S/c1-12-8-4-7(14-10-8)9(11)6-2-3-13-5-6/h4,6H,2-3,5H2,1H3.
What are the key properties of (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone?
(3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone has a molecular weight of 213.26 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-1,2-thiazol-5-yl)-(oxolan-3-yl)methanone is sourced from PubChem (CID 126999981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).