1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol

C22H22F2N2O2 — CID 177169603

IUPAC1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol
SMILESOC1CCCN(Cc2cc(OCc3ccc(F)cc3)c3cc(F)ccc3n2)C1
InChIInChI=1S/C22H22F2N2O2/c23-16-5-3-15(4-6-16)14-28-22-11-18(12-26-9-1-2-19(27)13-26)25-21-8-7-17(24)10-20(21)22/h3-8,10-11,19,27H,1-2,9,12-14H2
InChIKeySUOMXJQVBVSTEH-UHFFFAOYSA-N
MW384.43 g/mol
LogP4.05
Rot. Bonds5

About 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol

1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol (PubChem CID 177169603) has the molecular formula C22H22F2N2O2 and a molecular weight of 384.43 g/mol. Its IUPAC name is 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol
PubChem CID177169603
Molecular FormulaC22H22F2N2O2
Molecular Weight384.43 g/mol
Exact Mass384.16
IUPAC Name1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol
SMILESOC1CCCN(Cc2cc(OCc3ccc(F)cc3)c3cc(F)ccc3n2)C1
InChIInChI=1S/C22H22F2N2O2/c23-16-5-3-15(4-6-16)14-28-22-11-18(12-26-9-1-2-19(27)13-26)25-21-8-7-17(24)10-20(21)22/h3-8,10-11,19,27H,1-2,9,12-14H2
InChIKeySUOMXJQVBVSTEH-UHFFFAOYSA-N
XLogP4.05
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol with MolForge

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Related Compounds

1-[[4-[4-(6-fluoro-1H-benzimidazol-2-yl)phenyl]phenyl]methyl]piperidin-3-ol
CID 44526297
6-fluoro-4-[(4-fluorophenyl)methoxy]quinoline-2-carbaldehyde
CID 177169670
(3S)-1-[(3,5-difluorophenyl)methyl]piperidin-3-ol
CID 107225646
1-[[2-(aminomethyl)-4-fluorophenyl]methyl]piperidin-3-ol
CID 63289199
1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-3-ol
CID 24904753
[2-[(4-fluorophenyl)methoxy]phenyl]-(3-hydroxypiperidin-1-yl)methanone
CID 110878351
1-[(2-bromo-5-fluorophenyl)methyl]piperidin-3-ol
CID 62021902
(3S)-1-[(4-ethylphenyl)methyl]piperidin-3-ol
CID 27055523
2-fluoro-5-[(3-hydroxypiperidin-1-yl)methyl]benzenecarbothioamide
CID 107879245
(3S)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidin-3-ol
CID 29231219
4-[(3-hydroxypiperidin-1-yl)methyl]benzenecarbothioamide
CID 61434501
1-[(3-methoxy-4-methylsulfanylphenyl)methyl]piperidin-3-ol
CID 111111498

Frequently Asked Questions

What is the IUPAC name of 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol?
The IUPAC name of 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol (CID 177169603) is 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol.
What is the SMILES notation for 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol?
The canonical SMILES for 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol is OC1CCCN(Cc2cc(OCc3ccc(F)cc3)c3cc(F)ccc3n2)C1.
What is the InChIKey of 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol?
The InChIKey is SUOMXJQVBVSTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22F2N2O2/c23-16-5-3-15(4-6-16)14-28-22-11-18(12-26-9-1-2-19(27)13-26)25-21-8-7-17(24)10-20(21)22/h3-8,10-11,19,27H,1-2,9,12-14H2.
What are the key properties of 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol?
1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol has a molecular weight of 384.43 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[6-fluoro-4-[(4-fluorophenyl)methoxy]quinolin-2-yl]methyl]piperidin-3-ol is sourced from PubChem (CID 177169603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).