2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol

C15H17NO2 — CID 82718660

IUPAC2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol
SMILESCC1OCCC1(O)Cc1ccc2ccccc2n1
InChIInChI=1S/C15H17NO2/c1-11-15(17,8-9-18-11)10-13-7-6-12-4-2-3-5-14(12)16-13/h2-7,11,17H,8-10H2,1H3
InChIKeyMYHKGBUPPOETHC-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.32
Rot. Bonds2

About 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol

2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol (PubChem CID 82718660) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol.

Molecular Properties

Compound Name2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol
PubChem CID82718660
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol
SMILESCC1OCCC1(O)Cc1ccc2ccccc2n1
InChIInChI=1S/C15H17NO2/c1-11-15(17,8-9-18-11)10-13-7-6-12-4-2-3-5-14(12)16-13/h2-7,11,17H,8-10H2,1H3
InChIKeyMYHKGBUPPOETHC-UHFFFAOYSA-N
XLogP2.32
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol?
The IUPAC name of 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol (CID 82718660) is 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol.
What is the SMILES notation for 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol?
The canonical SMILES for 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol is CC1OCCC1(O)Cc1ccc2ccccc2n1.
What is the InChIKey of 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol?
The InChIKey is MYHKGBUPPOETHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11-15(17,8-9-18-11)10-13-7-6-12-4-2-3-5-14(12)16-13/h2-7,11,17H,8-10H2,1H3.
What are the key properties of 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol?
2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol has a molecular weight of 243.31 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(quinolin-2-ylmethyl)oxolan-3-ol is sourced from PubChem (CID 82718660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).