1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol

C10H15NO2S — CID 126985740

IUPAC1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol
SMILESCCC(O)(c1ccsn1)C1CCOC1
InChIInChI=1S/C10H15NO2S/c1-2-10(12,8-3-5-13-7-8)9-4-6-14-11-9/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyJUGOOTPMGZGMTN-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.78
Rot. Bonds3

About 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol

1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol (PubChem CID 126985740) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol
PubChem CID126985740
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol
SMILESCCC(O)(c1ccsn1)C1CCOC1
InChIInChI=1S/C10H15NO2S/c1-2-10(12,8-3-5-13-7-8)9-4-6-14-11-9/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyJUGOOTPMGZGMTN-UHFFFAOYSA-N
XLogP1.78
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Methyl-2-(1,2-thiazol-3-yl)butan-2-ol
CID 126985702
3-(3-Methyl-1,2-thiazol-5-yl)oxolan-3-ol
CID 126985746
2-Ethyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002598
1-Cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 127002599
2,6-Dimethyl-4-(1,2-thiazol-3-yl)oxan-4-ol
CID 130620480
4-Methyl-2-(1,2-thiazol-3-yl)pentan-2-ol
CID 130624388
1-Cyclohexyl-1-(1,2-thiazol-3-yl)ethanol
CID 130627757
2-(1,2-Thiazol-3-yl)pentan-2-ol
CID 130634722
2,2-Dimethyl-4-(1,2-thiazol-3-yl)oxan-4-ol
CID 130702883
1-(2-Methylcyclopropyl)-1-(1,2-thiazol-3-yl)propan-1-ol
CID 130705018
(2-Methyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol
CID 130715054
1-Cyclobutyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 130727353

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol?
The IUPAC name of 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol (CID 126985740) is 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol.
What is the SMILES notation for 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol?
The canonical SMILES for 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol is CCC(O)(c1ccsn1)C1CCOC1.
What is the InChIKey of 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol?
The InChIKey is JUGOOTPMGZGMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-2-10(12,8-3-5-13-7-8)9-4-6-14-11-9/h4,6,8,12H,2-3,5,7H2,1H3.
What are the key properties of 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol?
1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol has a molecular weight of 213.30 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol is sourced from PubChem (CID 126985740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).