2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol

C8H16O2 — CID 10909691

IUPAC2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol
SMILESC[C@H]1CC[C@H](C(C)(C)O)O1
InChIInChI=1S/C8H16O2/c1-6-4-5-7(10-6)8(2,3)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m0/s1
InChIKeyGDFJZYRQAYBNLM-NKWVEPMBSA-N
MW144.21 g/mol
LogP1.32
Rot. Bonds1

About 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol

2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol (PubChem CID 10909691) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol
PubChem CID10909691
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol
SMILESC[C@H]1CC[C@H](C(C)(C)O)O1
InChIInChI=1S/C8H16O2/c1-6-4-5-7(10-6)8(2,3)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m0/s1
InChIKeyGDFJZYRQAYBNLM-NKWVEPMBSA-N
XLogP1.32
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol?
The IUPAC name of 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol (CID 10909691) is 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol.
What is the SMILES notation for 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol?
The canonical SMILES for 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol is C[C@H]1CC[C@H](C(C)(C)O)O1.
What is the InChIKey of 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol?
The InChIKey is GDFJZYRQAYBNLM-NKWVEPMBSA-N. The full InChI is InChI=1S/C8H16O2/c1-6-4-5-7(10-6)8(2,3)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m0/s1.
What are the key properties of 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol?
2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol has a molecular weight of 144.21 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,5S)-5-methyloxolan-2-yl]propan-2-ol is sourced from PubChem (CID 10909691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).