[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol

C20H22N4O2 — CID 133475185

IUPAC[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol
SMILESOCc1cc2ccccc2nc1N1CCC(c2noc(C3CC3)n2)CC1
InChIInChI=1S/C20H22N4O2/c25-12-16-11-15-3-1-2-4-17(15)21-19(16)24-9-7-13(8-10-24)18-22-20(26-23-18)14-5-6-14/h1-4,11,13-14,25H,5-10,12H2
InChIKeyJIVORNFBKHSZCQ-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.37
Rot. Bonds4

About [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol

[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol (PubChem CID 133475185) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol.

Molecular Properties

Compound Name[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol
PubChem CID133475185
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol
SMILESOCc1cc2ccccc2nc1N1CCC(c2noc(C3CC3)n2)CC1
InChIInChI=1S/C20H22N4O2/c25-12-16-11-15-3-1-2-4-17(15)21-19(16)24-9-7-13(8-10-24)18-22-20(26-23-18)14-5-6-14/h1-4,11,13-14,25H,5-10,12H2
InChIKeyJIVORNFBKHSZCQ-UHFFFAOYSA-N
XLogP3.37
TPSA75.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol with MolForge

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Related Compounds

[2-(4-ethylpiperidin-1-yl)quinolin-3-yl]methanol
CID 61421257
5-methyl-3-[1-(3-methylquinolin-2-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 75384063
[2-[4-(4-phenyl-1H-pyrazol-5-yl)piperidin-1-yl]quinolin-3-yl]methanol
CID 56704240
5-cyclopropyl-3-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-oxadiazole
CID 133475123
(3R,4R)-4-(hydroxymethyl)-1-[3-(hydroxymethyl)quinolin-2-yl]piperidin-3-ol
CID 56884115
3-[1-(1-chloroisoquinolin-3-yl)piperidin-4-yl]-5-cyclopropyl-1,2,4-oxadiazole
CID 133475197
[2-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]quinolin-3-yl]methanol
CID 166208321
4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-[1]benzofuro[3,2-d]pyrimidine
CID 133475215
[2-[4-(3,5-dimethoxyanilino)piperidin-1-yl]quinolin-3-yl]methanol
CID 133337541
2-[1-[3-(hydroxymethyl)quinolin-2-yl]piperidin-3-yl]oxyethanol
CID 75421713
5-cyclopropyl-3-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 133474987
[2-[2-(2-methylphenyl)morpholin-4-yl]quinolin-3-yl]methanol
CID 133354127

Frequently Asked Questions

What is the IUPAC name of [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol?
The IUPAC name of [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol (CID 133475185) is [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol.
What is the SMILES notation for [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol?
The canonical SMILES for [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol is OCc1cc2ccccc2nc1N1CCC(c2noc(C3CC3)n2)CC1.
What is the InChIKey of [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol?
The InChIKey is JIVORNFBKHSZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c25-12-16-11-15-3-1-2-4-17(15)21-19(16)24-9-7-13(8-10-24)18-22-20(26-23-18)14-5-6-14/h1-4,11,13-14,25H,5-10,12H2.
What are the key properties of [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol?
[2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol has a molecular weight of 350.42 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]quinolin-3-yl]methanol is sourced from PubChem (CID 133475185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).