[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol

C9H14N2O2 — CID 130949666

IUPAC[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol
SMILESCn1nccc1[C@@H]1OCC[C@H]1CO
InChIInChI=1S/C9H14N2O2/c1-11-8(2-4-10-11)9-7(6-12)3-5-13-9/h2,4,7,9,12H,3,5-6H2,1H3/t7-,9+/m0/s1
InChIKeySQWRJTKNEOQJAP-IONNQARKSA-N
MW182.22 g/mol
LogP0.49
Rot. Bonds2

About [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol

[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol (PubChem CID 130949666) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol
PubChem CID130949666
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol
SMILESCn1nccc1[C@@H]1OCC[C@H]1CO
InChIInChI=1S/C9H14N2O2/c1-11-8(2-4-10-11)9-7(6-12)3-5-13-9/h2,4,7,9,12H,3,5-6H2,1H3/t7-,9+/m0/s1
InChIKeySQWRJTKNEOQJAP-IONNQARKSA-N
XLogP0.49
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-dimethyl-3-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]guanidine
CID 120965775
2,2-dicyclopropyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]acetamide
CID 127969351
N'-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]thiomorpholine-4-carboximidamide;hydroiodide
CID 120972854
(2R,6S)-2,6-dimethyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]oxan-4-amine
CID 129339482
5-bromo-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrimidin-2-amine
CID 128992017
N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]ethenesulfonamide
CID 167933645
1-(azepan-1-yl)-3-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methylamino]butan-1-one
CID 128972283
N-[(2-methoxyphenyl)methyl]-1-[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanamine
CID 126826944
3-[[4-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]piperazin-1-yl]methyl]-1,2-oxazole
CID 120916492
1-[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine
CID 128976235
N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]-2-pyrrolidin-1-ylethanesulfonamide
CID 100641729
3-tert-butyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]-1,2,4-thiadiazol-5-amine
CID 128998693

Frequently Asked Questions

What is the IUPAC name of [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol?
The IUPAC name of [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol (CID 130949666) is [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol.
What is the SMILES notation for [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol?
The canonical SMILES for [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol is Cn1nccc1[C@@H]1OCC[C@H]1CO.
What is the InChIKey of [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol?
The InChIKey is SQWRJTKNEOQJAP-IONNQARKSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-11-8(2-4-10-11)9-7(6-12)3-5-13-9/h2,4,7,9,12H,3,5-6H2,1H3/t7-,9+/m0/s1.
What are the key properties of [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol?
[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol has a molecular weight of 182.22 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methanol is sourced from PubChem (CID 130949666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).