4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol

C19H16N2OS — CID 174218840

IUPAC4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol
SMILESCc1cc2cc3nccc(Nc4cc(O)ccc4C)c3cc2s1
InChIInChI=1S/C19H16N2OS/c1-11-3-4-14(22)9-17(11)21-16-5-6-20-18-8-13-7-12(2)23-19(13)10-15(16)18/h3-10,22H,1-2H3,(H,20,21)
InChIKeyBWZCEMQBMHSDGS-UHFFFAOYSA-N
MW320.42 g/mol
LogP5.52
Rot. Bonds2

About 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol

4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol (PubChem CID 174218840) has the molecular formula C19H16N2OS and a molecular weight of 320.42 g/mol. Its IUPAC name is 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol.

Molecular Properties

Compound Name4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol
PubChem CID174218840
Molecular FormulaC19H16N2OS
Molecular Weight320.42 g/mol
Exact Mass320.10
IUPAC Name4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol
SMILESCc1cc2cc3nccc(Nc4cc(O)ccc4C)c3cc2s1
InChIInChI=1S/C19H16N2OS/c1-11-3-4-14(22)9-17(11)21-16-5-6-20-18-8-13-7-12(2)23-19(13)10-15(16)18/h3-10,22H,1-2H3,(H,20,21)
InChIKeyBWZCEMQBMHSDGS-UHFFFAOYSA-N
XLogP5.52
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.42
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-(aminomethyl)-2-methylphenyl]-2-methylthieno[2,3-g]quinolin-8-amine
CID 156805033
5-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]pyridin-3-ol
CID 174218847
2-fluoro-4-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol
CID 156804987
3-[(6-dimethylphosphanylquinolin-4-yl)amino]-4-methylphenol
CID 165123425
N-(1,3-benzothiazol-5-yl)-2-methylthieno[2,3-g]quinolin-8-amine
CID 156805035
ethyl 4-(5-hydroxy-2-methylanilino)quinoline-6-carboxylate
CID 58170411
4-(5-hydroxy-2-methylanilino)-N-(2-methylsulfonylethyl)quinoline-6-carboxamide
CID 54672856
ethanol;ethyl 4-(5-hydroxy-2-methylanilino)quinoline-6-carboxylate;4-(5-hydroxy-2-methylanilino)quinoline-6-carboxylic acid
CID 162050100
3-[[7-[4-[(2-methoxyethylamino)methyl]-1,3-thiazol-5-yl]quinolin-4-yl]amino]-4-methylphenol
CID 44532521
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(5-hydroxy-2-methylanilino)quinoline-8-carboxamide
CID 118339831
3-methyl-4-[(2-methyl-1,1-dioxothieno[2,3-g]quinolin-8-yl)amino]phenol
CID 156576013
4-(5-hydroxy-2-methylanilino)-N-(2-methylsulfonylethyl)quinoline-8-carboxamide
CID 118339805

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol?
The IUPAC name of 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol (CID 174218840) is 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol.
What is the SMILES notation for 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol?
The canonical SMILES for 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol is Cc1cc2cc3nccc(Nc4cc(O)ccc4C)c3cc2s1.
What is the InChIKey of 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol?
The InChIKey is BWZCEMQBMHSDGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2OS/c1-11-3-4-14(22)9-17(11)21-16-5-6-20-18-8-13-7-12(2)23-19(13)10-15(16)18/h3-10,22H,1-2H3,(H,20,21).
What are the key properties of 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol?
4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol has a molecular weight of 320.42 g/mol, XLogP of 5.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(2-methylthieno[2,3-g]quinolin-8-yl)amino]phenol is sourced from PubChem (CID 174218840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).