8-methoxy-5-(piperidin-1-ylmethyl)quinoline

C16H20N2O — CID 135293876

IUPAC8-methoxy-5-(piperidin-1-ylmethyl)quinoline
SMILESCOc1ccc(CN2CCCCC2)c2cccnc12
InChIInChI=1S/C16H20N2O/c1-19-15-8-7-13(12-18-10-3-2-4-11-18)14-6-5-9-17-16(14)15/h5-9H,2-4,10-12H2,1H3
InChIKeyGXIBEACXMFOZHC-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.23
Rot. Bonds3

About 8-methoxy-5-(piperidin-1-ylmethyl)quinoline

8-methoxy-5-(piperidin-1-ylmethyl)quinoline (PubChem CID 135293876) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 8-methoxy-5-(piperidin-1-ylmethyl)quinoline.

Molecular Properties

Compound Name8-methoxy-5-(piperidin-1-ylmethyl)quinoline
PubChem CID135293876
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name8-methoxy-5-(piperidin-1-ylmethyl)quinoline
SMILESCOc1ccc(CN2CCCCC2)c2cccnc12
InChIInChI=1S/C16H20N2O/c1-19-15-8-7-13(12-18-10-3-2-4-11-18)14-6-5-9-17-16(14)15/h5-9H,2-4,10-12H2,1H3
InChIKeyGXIBEACXMFOZHC-UHFFFAOYSA-N
XLogP3.23
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2,3,4-trimethoxyphenyl)methyl]azepane
CID 23736534
8-methoxy-5-piperidin-1-ylquinoline
CID 86218648
[5-(pyrrolidin-1-ylmethyl)quinolin-8-yl] 2-methylbenzoate
CID 5119641
1-(8-methoxyquinolin-5-yl)-N-methylmethanamine
CID 16640560
N-[(8-methoxyquinolin-5-yl)methyl]hydroxylamine
CID 117292523
3-(azepan-1-yl)-1-(8-methoxyquinolin-5-yl)propan-1-one
CID 93193167
4-[[2-(8-methoxyquinolin-5-yl)phenyl]methyl]morpholine
CID 72915247
5,7-bis(piperidin-1-ylmethyl)quinolin-8-ol
CID 3470863
methanol;5-[(4-methyl-1,4-diazepan-1-yl)methyl]quinolin-8-ol
CID 142849611
5-(ethoxymethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol
CID 23604739
5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol
CID 23765907
[5-[(4-prop-2-ynylpiperidin-1-yl)methyl]quinolin-8-yl] N,N-dimethylcarbamate
CID 46843060

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-5-(piperidin-1-ylmethyl)quinoline?
The IUPAC name of 8-methoxy-5-(piperidin-1-ylmethyl)quinoline (CID 135293876) is 8-methoxy-5-(piperidin-1-ylmethyl)quinoline.
What is the SMILES notation for 8-methoxy-5-(piperidin-1-ylmethyl)quinoline?
The canonical SMILES for 8-methoxy-5-(piperidin-1-ylmethyl)quinoline is COc1ccc(CN2CCCCC2)c2cccnc12.
What is the InChIKey of 8-methoxy-5-(piperidin-1-ylmethyl)quinoline?
The InChIKey is GXIBEACXMFOZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-19-15-8-7-13(12-18-10-3-2-4-11-18)14-6-5-9-17-16(14)15/h5-9H,2-4,10-12H2,1H3.
What are the key properties of 8-methoxy-5-(piperidin-1-ylmethyl)quinoline?
8-methoxy-5-(piperidin-1-ylmethyl)quinoline has a molecular weight of 256.35 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-5-(piperidin-1-ylmethyl)quinoline is sourced from PubChem (CID 135293876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).