2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride

C18H19ClN2O — CID 135472789

IUPAC2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride
SMILESCc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1C.Cl
InChIInChI=1S/C18H18N2O.ClH/c1-11-4-5-14(8-12(11)2)19-18-9-13(3)16-7-6-15(21)10-17(16)20-18;/h4-10,21H,1-3H3,(H,19,20);1H
InChIKeyDIRZUVDMGFYHGA-UHFFFAOYSA-N
MW314.82 g/mol
LogP5.03
Rot. Bonds2

About 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride

2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride (PubChem CID 135472789) has the molecular formula C18H19ClN2O and a molecular weight of 314.82 g/mol. Its IUPAC name is 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride.

Molecular Properties

Compound Name2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride
PubChem CID135472789
Molecular FormulaC18H19ClN2O
Molecular Weight314.82 g/mol
Exact Mass314.12
IUPAC Name2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride
SMILESCc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1C.Cl
InChIInChI=1S/C18H18N2O.ClH/c1-11-4-5-14(8-12(11)2)19-18-9-13(3)16-7-6-15(21)10-17(16)20-18;/h4-10,21H,1-3H3,(H,19,20);1H
InChIKeyDIRZUVDMGFYHGA-UHFFFAOYSA-N
XLogP5.03
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.82
LogP ≤ 55.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride 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

4-Methyl-2-(4-phenylmethoxyanilino)quinolin-7-ol
CID 135609775
2-[(2,3-Dimethylphenyl)amino]-4-methylquinolin-5-ol
CID 135521448
3-[(2-Phenylquinazolin-4-yl)amino]phenol
CID 693197
2-[4-[Cyclopentyl(methyl)amino]piperidin-1-yl]-4-methylquinolin-7-ol
CID 5307341
4-[4-(Tert-butylamino)-2-(trifluoromethyl)quinazolin-6-yl]phenol
CID 5330925
2-(4-Ethylanilino)-4-methylquinolin-7-ol;hydrochloride
CID 135971382
N-(3-methoxyphenyl)-4-methylquinolin-2-amine
CID 910456
4-methyl-2-(4-methylpiperidin-1-yl)-1H-quinolin-5-one
CID 135476890
2-(Benzylamino)-4-methylquinolin-7-ol
CID 135857476
3-[[4-(Benzylamino)quinazolin-2-yl]amino]phenol
CID 962695
2-(3-Fluoro-4-Methyl-Anilino)-4-Methyl-Quinolin-5-Ol
CID 135567046
4-Methyl-2-morpholin-4-ylquinolin-7-ol
CID 5307155

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride?
The IUPAC name of 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride (CID 135472789) is 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride.
What is the SMILES notation for 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride?
The canonical SMILES for 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride is Cc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1C.Cl.
What is the InChIKey of 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride?
The InChIKey is DIRZUVDMGFYHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O.ClH/c1-11-4-5-14(8-12(11)2)19-18-9-13(3)16-7-6-15(21)10-17(16)20-18;/h4-10,21H,1-3H3,(H,19,20);1H.
What are the key properties of 2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride?
2-(3,4-dimethylanilino)-4-methylquinolin-7-ol;hydrochloride has a molecular weight of 314.82 g/mol, XLogP of 5.03, 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)-4-methylquinolin-7-ol;hydrochloride is sourced from PubChem (CID 135472789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).