2-(3,4-dimethylanilino)quinolin-5-ol

C17H16N2O — CID 142739435

IUPAC2-(3,4-dimethylanilino)quinolin-5-ol
SMILESCc1ccc(Nc2ccc3c(O)cccc3n2)cc1C
InChIInChI=1S/C17H16N2O/c1-11-6-7-13(10-12(11)2)18-17-9-8-14-15(19-17)4-3-5-16(14)20/h3-10,20H,1-2H3,(H,18,19)
InChIKeyHTRTVCGNJAXQTH-UHFFFAOYSA-N
MW264.33 g/mol
LogP4.30
Rot. Bonds2

About 2-(3,4-dimethylanilino)quinolin-5-ol

2-(3,4-dimethylanilino)quinolin-5-ol (PubChem CID 142739435) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(3,4-dimethylanilino)quinolin-5-ol.

Molecular Properties

Compound Name2-(3,4-dimethylanilino)quinolin-5-ol
PubChem CID142739435
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name2-(3,4-dimethylanilino)quinolin-5-ol
SMILESCc1ccc(Nc2ccc3c(O)cccc3n2)cc1C
InChIInChI=1S/C17H16N2O/c1-11-6-7-13(10-12(11)2)18-17-9-8-14-15(19-17)4-3-5-16(14)20/h3-10,20H,1-2H3,(H,18,19)
InChIKeyHTRTVCGNJAXQTH-UHFFFAOYSA-N
XLogP4.30
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylanilino)quinolin-5-ol?
The IUPAC name of 2-(3,4-dimethylanilino)quinolin-5-ol (CID 142739435) is 2-(3,4-dimethylanilino)quinolin-5-ol.
What is the SMILES notation for 2-(3,4-dimethylanilino)quinolin-5-ol?
The canonical SMILES for 2-(3,4-dimethylanilino)quinolin-5-ol is Cc1ccc(Nc2ccc3c(O)cccc3n2)cc1C.
What is the InChIKey of 2-(3,4-dimethylanilino)quinolin-5-ol?
The InChIKey is HTRTVCGNJAXQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-11-6-7-13(10-12(11)2)18-17-9-8-14-15(19-17)4-3-5-16(14)20/h3-10,20H,1-2H3,(H,18,19).
What are the key properties of 2-(3,4-dimethylanilino)quinolin-5-ol?
2-(3,4-dimethylanilino)quinolin-5-ol has a molecular weight of 264.33 g/mol, XLogP of 4.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylanilino)quinolin-5-ol is sourced from PubChem (CID 142739435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).