1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol

C15H17NO3 — CID 103547520

IUPAC1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol
SMILESOC(Cc1ccnc2ccccc12)CC1OCCO1
InChIInChI=1S/C15H17NO3/c17-12(10-15-18-7-8-19-15)9-11-5-6-16-14-4-2-1-3-13(11)14/h1-6,12,15,17H,7-10H2
InChIKeyOLOGYLCLFKEZBS-UHFFFAOYSA-N
MW259.30 g/mol
LogP1.90
Rot. Bonds4

About 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol

1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol (PubChem CID 103547520) has the molecular formula C15H17NO3 and a molecular weight of 259.30 g/mol. Its IUPAC name is 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol
PubChem CID103547520
Molecular FormulaC15H17NO3
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Name1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol
SMILESOC(Cc1ccnc2ccccc12)CC1OCCO1
InChIInChI=1S/C15H17NO3/c17-12(10-15-18-7-8-19-15)9-11-5-6-16-14-4-2-1-3-13(11)14/h1-6,12,15,17H,7-10H2
InChIKeyOLOGYLCLFKEZBS-UHFFFAOYSA-N
XLogP1.90
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cycloheptyl-3-quinolin-4-ylpropan-2-ol
CID 115812509
1-cyclopropyl-2-quinolin-4-ylethanol
CID 63353390
1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-one
CID 103543731
1-(3-methyloxolan-2-yl)-2-quinolin-4-ylethanol
CID 115812514
1-[4-[(2S)-2-hydroxy-3-quinolin-4-ylpropyl]piperidin-1-yl]ethanone
CID 92534411
3-quinolin-4-yl-2-(quinolin-4-ylmethyl)propanal
CID 19824915
4-(diethylamino)-1-quinolin-4-ylbutan-2-ol
CID 79087937
1-quinolin-4-yl-3-(2,2,2-trifluoroethoxy)propan-2-ol
CID 103216898
N-methyl-1-(oxan-2-yl)-2-quinolin-4-ylethanamine
CID 104997415
4-(2-bromo-2-phenylethyl)quinoline
CID 63202521
1-cyclobutyl-3-quinolin-4-ylpropan-2-amine
CID 103168915
4-(2-ethylbutyl)quinoline
CID 143495355

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol?
The IUPAC name of 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol (CID 103547520) is 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol.
What is the SMILES notation for 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol?
The canonical SMILES for 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol is OC(Cc1ccnc2ccccc12)CC1OCCO1.
What is the InChIKey of 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol?
The InChIKey is OLOGYLCLFKEZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c17-12(10-15-18-7-8-19-15)9-11-5-6-16-14-4-2-1-3-13(11)14/h1-6,12,15,17H,7-10H2.
What are the key properties of 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol?
1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol has a molecular weight of 259.30 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dioxolan-2-yl)-3-quinolin-4-ylpropan-2-ol is sourced from PubChem (CID 103547520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).