3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol

C14H16N2O2 — CID 129410623

IUPAC3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol
SMILESOc1ccc2ncc(NC[C@H]3CCOC3)cc2c1
InChIInChI=1S/C14H16N2O2/c17-13-1-2-14-11(6-13)5-12(8-16-14)15-7-10-3-4-18-9-10/h1-2,5-6,8,10,15,17H,3-4,7,9H2/t10-/m1/s1
InChIKeyVFEJXKXPQJCPOM-SNVBAGLBSA-N
MW244.29 g/mol
LogP2.39
Rot. Bonds3

About 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol

3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol (PubChem CID 129410623) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol.

Molecular Properties

Compound Name3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol
PubChem CID129410623
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol
SMILESOc1ccc2ncc(NC[C@H]3CCOC3)cc2c1
InChIInChI=1S/C14H16N2O2/c17-13-1-2-14-11(6-13)5-12(8-16-14)15-7-10-3-4-18-9-10/h1-2,5-6,8,10,15,17H,3-4,7,9H2/t10-/m1/s1
InChIKeyVFEJXKXPQJCPOM-SNVBAGLBSA-N
XLogP2.39
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(oxolan-3-ylamino)quinolin-6-ol
CID 89443563
N-(piperidin-4-ylmethyl)quinolin-3-amine
CID 79707909
1-(oxan-3-ylmethylamino)isoquinolin-7-ol
CID 106537797
6-[(oxolan-3-ylmethylamino)methyl]pyridin-3-ol
CID 79781899
N-(oxolan-3-ylmethyl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689591
2-methyl-N-(oxolan-3-ylmethyl)-3H-benzimidazol-5-amine
CID 43746507
N-(oxan-4-ylmethyl)quinoxalin-2-amine
CID 62351550
4-N-(oxolan-3-ylmethyl)benzene-1,4-diamine
CID 62824000
5-(oxan-4-ylmethylamino)pyridine-2-carboxylic acid
CID 115490926
5-iodo-N-(oxolan-3-ylmethyl)pyrimidin-2-amine
CID 104841332
2-N-(oxolan-3-ylmethyl)quinoline-2,6-diamine
CID 62822753
3,4-diethoxy-N-(oxolan-3-ylmethyl)aniline
CID 43193089

Frequently Asked Questions

What is the IUPAC name of 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol?
The IUPAC name of 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol (CID 129410623) is 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol.
What is the SMILES notation for 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol?
The canonical SMILES for 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol is Oc1ccc2ncc(NC[C@H]3CCOC3)cc2c1.
What is the InChIKey of 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol?
The InChIKey is VFEJXKXPQJCPOM-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13-1-2-14-11(6-13)5-12(8-16-14)15-7-10-3-4-18-9-10/h1-2,5-6,8,10,15,17H,3-4,7,9H2/t10-/m1/s1.
What are the key properties of 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol?
3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol has a molecular weight of 244.29 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3R)-oxolan-3-yl]methylamino]quinolin-6-ol is sourced from PubChem (CID 129410623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).