4-[1-(dimethylamino)ethyl]quinolin-3-ol

C13H16N2O — CID 14117632

IUPAC4-[1-(dimethylamino)ethyl]quinolin-3-ol
SMILESCC(c1c(O)cnc2ccccc12)N(C)C
InChIInChI=1S/C13H16N2O/c1-9(15(2)3)13-10-6-4-5-7-11(10)14-8-12(13)16/h4-9,16H,1-3H3
InChIKeyKIPNXSYWVUXWPF-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.56
Rot. Bonds2

About 4-[1-(dimethylamino)ethyl]quinolin-3-ol

4-[1-(dimethylamino)ethyl]quinolin-3-ol (PubChem CID 14117632) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 4-[1-(dimethylamino)ethyl]quinolin-3-ol.

Molecular Properties

Compound Name4-[1-(dimethylamino)ethyl]quinolin-3-ol
PubChem CID14117632
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name4-[1-(dimethylamino)ethyl]quinolin-3-ol
SMILESCC(c1c(O)cnc2ccccc12)N(C)C
InChIInChI=1S/C13H16N2O/c1-9(15(2)3)13-10-6-4-5-7-11(10)14-8-12(13)16/h4-9,16H,1-3H3
InChIKeyKIPNXSYWVUXWPF-UHFFFAOYSA-N
XLogP2.56
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(dimethylamino)ethyl]quinolin-3-ol?
The IUPAC name of 4-[1-(dimethylamino)ethyl]quinolin-3-ol (CID 14117632) is 4-[1-(dimethylamino)ethyl]quinolin-3-ol.
What is the SMILES notation for 4-[1-(dimethylamino)ethyl]quinolin-3-ol?
The canonical SMILES for 4-[1-(dimethylamino)ethyl]quinolin-3-ol is CC(c1c(O)cnc2ccccc12)N(C)C.
What is the InChIKey of 4-[1-(dimethylamino)ethyl]quinolin-3-ol?
The InChIKey is KIPNXSYWVUXWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9(15(2)3)13-10-6-4-5-7-11(10)14-8-12(13)16/h4-9,16H,1-3H3.
What are the key properties of 4-[1-(dimethylamino)ethyl]quinolin-3-ol?
4-[1-(dimethylamino)ethyl]quinolin-3-ol has a molecular weight of 216.28 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(dimethylamino)ethyl]quinolin-3-ol is sourced from PubChem (CID 14117632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).