2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole

C10H15NO2S — CID 107511836

IUPAC2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole
SMILESCOCc1csc(C(OC)C2CC2)n1
InChIInChI=1S/C10H15NO2S/c1-12-5-8-6-14-10(11-8)9(13-2)7-3-4-7/h6-7,9H,3-5H2,1-2H3
InChIKeyWWOPVUWREDBIHR-UHFFFAOYSA-N
MW213.30 g/mol
LogP2.39
Rot. Bonds5

About 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole

2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole (PubChem CID 107511836) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole
PubChem CID107511836
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole
SMILESCOCc1csc(C(OC)C2CC2)n1
InChIInChI=1S/C10H15NO2S/c1-12-5-8-6-14-10(11-8)9(13-2)7-3-4-7/h6-7,9H,3-5H2,1-2H3
InChIKeyWWOPVUWREDBIHR-UHFFFAOYSA-N
XLogP2.39
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-[cyclopropyl(methoxy)methyl]-1,3-thiazol-4-yl]methyl]propan-2-amine
CID 116727916
N-[[2-[cyclopropyl(methoxy)methyl]-1,3-thiazol-4-yl]methyl]cyclopropanamine
CID 116727926
4-(methoxymethyl)-2-(1-methoxy-2-methylpropyl)-1,3-thiazole
CID 107511953
2-[cyclohexyl(methoxy)methyl]-1,3-thiazol-4-ol
CID 130501377
methyl 2-[2-[cyclopropyl(ethoxy)methyl]-1,3-thiazol-4-yl]acetate
CID 116705291
4-(chloromethyl)-2-[cyclopropyl(ethoxy)methyl]-1,3-thiazole
CID 116705113
2-(2,2-dimethylcyclopropyl)-4-(methoxymethyl)-1,3-thiazole
CID 107924795
1-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2,2-dimethylpropan-1-amine
CID 107507037
1-[2-[cyclohexyl(methoxy)methyl]-1,3-thiazol-4-yl]ethanone
CID 116774203
2-(1-ethoxybutyl)-4-(methoxymethyl)-1,3-thiazole
CID 107512034
N-[[2-[cyclohexyl(ethoxy)methyl]-1,3-thiazol-4-yl]methyl]propan-2-amine
CID 116774768
4-(3-bromophenyl)-2-[cyclopropyl(methoxy)methyl]-1,3-thiazole
CID 116734465

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole?
The IUPAC name of 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole (CID 107511836) is 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole.
What is the SMILES notation for 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole?
The canonical SMILES for 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole is COCc1csc(C(OC)C2CC2)n1.
What is the InChIKey of 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole?
The InChIKey is WWOPVUWREDBIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-12-5-8-6-14-10(11-8)9(13-2)7-3-4-7/h6-7,9H,3-5H2,1-2H3.
What are the key properties of 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole?
2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole has a molecular weight of 213.30 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(methoxy)methyl]-4-(methoxymethyl)-1,3-thiazole is sourced from PubChem (CID 107511836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).