5-(pyrrolidin-1-ylmethyl)quinolin-8-ol

C14H16N2O — CID 776032

IUPAC5-(pyrrolidin-1-ylmethyl)quinolin-8-ol
SMILESOc1ccc(CN2CCCC2)c2cccnc12
InChIInChI=1S/C14H16N2O/c17-13-6-5-11(10-16-8-1-2-9-16)12-4-3-7-15-14(12)13/h3-7,17H,1-2,8-10H2
InChIKeyYIDLQDBGBKKOGB-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.54
Rot. Bonds2

About 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol

5-(pyrrolidin-1-ylmethyl)quinolin-8-ol (PubChem CID 776032) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol.

Molecular Properties

Compound Name5-(pyrrolidin-1-ylmethyl)quinolin-8-ol
PubChem CID776032
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name5-(pyrrolidin-1-ylmethyl)quinolin-8-ol
SMILESOc1ccc(CN2CCCC2)c2cccnc12
InChIInChI=1S/C14H16N2O/c17-13-6-5-11(10-16-8-1-2-9-16)12-4-3-7-15-14(12)13/h3-7,17H,1-2,8-10H2
InChIKeyYIDLQDBGBKKOGB-UHFFFAOYSA-N
XLogP2.54
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-Hydroxyquinoline
CID 1923
5,7-Diiodo-8-hydroxyquinoline
CID 3728
Hydroxyquinoline sulfate
CID 517000
2-Methyl-8-hydroxyquinoline
CID 13224
8-Hydroxyquinoline N-oxide
CID 14312
5-Methyl-8-hydroxyquinoline
CID 71208
5-Amino-8-hydroxyquinoline
CID 416002
3-Hydroxyquinoline
CID 11376
5-(N-methyl-N-propargylaminomethyl)-8-hydroxyquinoline
CID 6918822
Tilbroquinol
CID 65592
5-Fluoro-8-quinolinol
CID 217907
Stannane, (8-quinolinolato)tributyl-
CID 16683764

Frequently Asked Questions

What is the IUPAC name of 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol?
The IUPAC name of 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol (CID 776032) is 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol.
What is the SMILES notation for 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol?
The canonical SMILES for 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol is Oc1ccc(CN2CCCC2)c2cccnc12.
What is the InChIKey of 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol?
The InChIKey is YIDLQDBGBKKOGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c17-13-6-5-11(10-16-8-1-2-9-16)12-4-3-7-15-14(12)13/h3-7,17H,1-2,8-10H2.
What are the key properties of 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol?
5-(pyrrolidin-1-ylmethyl)quinolin-8-ol has a molecular weight of 228.30 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(pyrrolidin-1-ylmethyl)quinolin-8-ol is sourced from PubChem (CID 776032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).