[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol

C22H24FN3O2 — CID 25144311

IUPAC[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol
SMILESCc1cc(OC2CCN(Cc3cccnc3CO)CC2)c2cccc(F)c2n1
InChIInChI=1S/C22H24FN3O2/c1-15-12-21(18-5-2-6-19(23)22(18)25-15)28-17-7-10-26(11-8-17)13-16-4-3-9-24-20(16)14-27/h2-6,9,12,17,27H,7-8,10-11,13-14H2,1H3
InChIKeyMWMZCYIOALZGKS-UHFFFAOYSA-N
MW381.45 g/mol
LogP3.61
Rot. Bonds5

About [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol

[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol (PubChem CID 25144311) has the molecular formula C22H24FN3O2 and a molecular weight of 381.45 g/mol. Its IUPAC name is [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol
PubChem CID25144311
Molecular FormulaC22H24FN3O2
Molecular Weight381.45 g/mol
Exact Mass381.19
IUPAC Name[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol
SMILESCc1cc(OC2CCN(Cc3cccnc3CO)CC2)c2cccc(F)c2n1
InChIInChI=1S/C22H24FN3O2/c1-15-12-21(18-5-2-6-19(23)22(18)25-15)28-17-7-10-26(11-8-17)13-16-4-3-9-24-20(16)14-27/h2-6,9,12,17,27H,7-8,10-11,13-14H2,1H3
InChIKeyMWMZCYIOALZGKS-UHFFFAOYSA-N
XLogP3.61
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol with MolForge

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Related Compounds

3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]pyridine-2-carboxylic acid
CID 25145573
5-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-hydroxybenzoic acid
CID 25144595
4-(1-benzylpiperidin-4-yl)oxy-8-fluoro-2-(trifluoromethyl)quinoline
CID 2823567
4-cyclopentyloxy-2-methylquinolin-8-ol
CID 19603475
5-[[3-(2-fluorophenoxy)azetidin-1-yl]methyl]quinoline
CID 74238263
(4S,5S)-5-(2-fluorophenoxy)-1-[(3-methyl-2-pyridinyl)methyl]azepan-4-ol
CID 155987584
1-[(3-cyclopropyloxy-2-fluorophenyl)methyl]-4-methoxypiperidine
CID 138034260
2-[4-(2-methylquinolin-4-yl)oxypiperidin-1-yl]acetic acid
CID 58948368
8-fluoro-2-methyl-4-(3-pyridin-3-yloxypyrrolidin-1-yl)quinoline
CID 133369289
3-[[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-N,N-dimethylaniline
CID 136537189
3-[[4-(2-fluorophenoxy)piperidin-1-yl]methyl]-2,7-dimethylimidazo[1,2-a]pyridine
CID 46981016
8-fluoro-2-methyl-N-[3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]quinolin-4-amine
CID 133393992

Frequently Asked Questions

What is the IUPAC name of [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol?
The IUPAC name of [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol (CID 25144311) is [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol.
What is the SMILES notation for [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol?
The canonical SMILES for [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol is Cc1cc(OC2CCN(Cc3cccnc3CO)CC2)c2cccc(F)c2n1.
What is the InChIKey of [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol?
The InChIKey is MWMZCYIOALZGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN3O2/c1-15-12-21(18-5-2-6-19(23)22(18)25-15)28-17-7-10-26(11-8-17)13-16-4-3-9-24-20(16)14-27/h2-6,9,12,17,27H,7-8,10-11,13-14H2,1H3.
What are the key properties of [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol?
[3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol has a molecular weight of 381.45 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[4-(8-fluoro-2-methylquinolin-4-yl)oxypiperidin-1-yl]methyl]-2-pyridinyl]methanol is sourced from PubChem (CID 25144311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).