4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine

C21H29N3O — CID 77083947

IUPAC4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine
SMILESCc1ccc2ncccc2c1CN1CCCCC1CN1CCOCC1
InChIInChI=1S/C21H29N3O/c1-17-7-8-21-19(6-4-9-22-21)20(17)16-24-10-3-2-5-18(24)15-23-11-13-25-14-12-23/h4,6-9,18H,2-3,5,10-16H2,1H3
InChIKeyHXIFJHVNVSZCSH-UHFFFAOYSA-N
MW339.48 g/mol
LogP3.23
Rot. Bonds4

About 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine

4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine (PubChem CID 77083947) has the molecular formula C21H29N3O and a molecular weight of 339.48 g/mol. Its IUPAC name is 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine
PubChem CID77083947
Molecular FormulaC21H29N3O
Molecular Weight339.48 g/mol
Exact Mass339.23
IUPAC Name4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine
SMILESCc1ccc2ncccc2c1CN1CCCCC1CN1CCOCC1
InChIInChI=1S/C21H29N3O/c1-17-7-8-21-19(6-4-9-22-21)20(17)16-24-10-3-2-5-18(24)15-23-11-13-25-14-12-23/h4,6-9,18H,2-3,5,10-16H2,1H3
InChIKeyHXIFJHVNVSZCSH-UHFFFAOYSA-N
XLogP3.23
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.48
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine with MolForge

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Related Compounds

[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol
CID 74232945
4-[[1-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperidin-2-yl]methyl]morpholine
CID 46967160
4-[[1-(imidazo[1,2-a]pyrazin-3-ylmethyl)piperidin-2-yl]methyl]morpholine
CID 154751583
3-[(2R)-1-methylpiperidin-2-yl]-N-[(6-methylquinolin-5-yl)methyl]propanamide
CID 97209684
4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine
CID 133309507
4-[[1-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]piperidin-2-yl]methyl]morpholine
CID 70786625
4-[[(2S)-1-[(2,3,4-trifluorophenyl)methyl]piperidin-2-yl]methyl]morpholine
CID 99930489
4-[[(2S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-2-yl]methyl]morpholine
CID 97158896
4-(quinolin-5-ylmethyl)-1,4-oxazepane
CID 29183639
(6R,11S)-11-hydroxy-8-[(6-methylquinolin-5-yl)methyl]-2,8-diazaspiro[5.5]undecan-1-one
CID 165423962
2-[[(2R)-2-(2-morpholin-4-ylethyl)piperidin-1-yl]methyl]pyridine-3-carboxylic acid
CID 95132226
[(4aS,8aS)-1-methyl-7-[(6-methylquinolin-5-yl)methyl]-3,4,5,6,8,8a-hexahydro-2H-1,7-naphthyridin-4a-yl]methanol
CID 135107879

Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine?
The IUPAC name of 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine (CID 77083947) is 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine is Cc1ccc2ncccc2c1CN1CCCCC1CN1CCOCC1.
What is the InChIKey of 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine?
The InChIKey is HXIFJHVNVSZCSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O/c1-17-7-8-21-19(6-4-9-22-21)20(17)16-24-10-3-2-5-18(24)15-23-11-13-25-14-12-23/h4,6-9,18H,2-3,5,10-16H2,1H3.
What are the key properties of 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine?
4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine has a molecular weight of 339.48 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(6-methylquinolin-5-yl)methyl]piperidin-2-yl]methyl]morpholine is sourced from PubChem (CID 77083947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).