5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol

C16H20N2O — CID 23765907

IUPAC5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol
SMILESCc1cc(CN2CCCCC2)c(O)c2ncccc12
InChIInChI=1S/C16H20N2O/c1-12-10-13(11-18-8-3-2-4-9-18)16(19)15-14(12)6-5-7-17-15/h5-7,10,19H,2-4,8-9,11H2,1H3
InChIKeyLQMLRTWRTWAEJN-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.23
Rot. Bonds2

About 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol

5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol (PubChem CID 23765907) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol.

Molecular Properties

Compound Name5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol
PubChem CID23765907
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol
SMILESCc1cc(CN2CCCCC2)c(O)c2ncccc12
InChIInChI=1S/C16H20N2O/c1-12-10-13(11-18-8-3-2-4-9-18)16(19)15-14(12)6-5-7-17-15/h5-7,10,19H,2-4,8-9,11H2,1H3
InChIKeyLQMLRTWRTWAEJN-UHFFFAOYSA-N
XLogP3.23
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

5,7-bis(piperidin-1-ylmethyl)quinolin-8-ol
CID 3470863
5-(ethoxymethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol
CID 23604739
5-chloro-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
CID 716609
5-bromo-7-[(4-ethylpiperazin-1-yl)methyl]quinolin-8-ol
CID 18830094
ethane;7-methyl-5-[(1-oxo-1,4-thiazinan-4-yl)methyl]quinolin-8-ol
CID 171541796
5-chloro-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-ol;dihydrochloride
CID 131888000
ethyl 4-[[7-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-8-hydroxyquinolin-5-yl]methyl]piperazine-1-carboxylate
CID 3471245
7-[[4-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]-2,5-dimethylpiperazin-1-yl]methyl]-5-methylquinolin-8-ol
CID 157165811
7-(morpholin-4-ylmethyl)-5-(propan-2-yloxymethyl)quinolin-8-ol
CID 23604749
5,7-dimethylquinolin-8-ol
CID 118341298
5-[[4-(4-ethylphenyl)triazol-2-yl]methyl]-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
CID 164620822
N-[1-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]piperidin-4-yl]cyclohexanecarboxamide
CID 91667484

Frequently Asked Questions

What is the IUPAC name of 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol?
The IUPAC name of 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol (CID 23765907) is 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol.
What is the SMILES notation for 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol?
The canonical SMILES for 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol is Cc1cc(CN2CCCCC2)c(O)c2ncccc12.
What is the InChIKey of 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol?
The InChIKey is LQMLRTWRTWAEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12-10-13(11-18-8-3-2-4-9-18)16(19)15-14(12)6-5-7-17-15/h5-7,10,19H,2-4,8-9,11H2,1H3.
What are the key properties of 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol?
5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol has a molecular weight of 256.35 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol is sourced from PubChem (CID 23765907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).