4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride

C17H17ClN2O2 — CID 135802999

IUPAC4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride
SMILESCOc1cccc(Nc2cc(C)nc3cc(O)ccc23)c1.Cl
InChIInChI=1S/C17H16N2O2.ClH/c1-11-8-16(15-7-6-13(20)10-17(15)18-11)19-12-4-3-5-14(9-12)21-2;/h3-10,20H,1-2H3,(H,18,19);1H
InChIKeyWPVGFASDFISMSI-UHFFFAOYSA-N
MW316.79 g/mol
LogP4.42
Rot. Bonds3

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

4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride (PubChem CID 135802999) has the molecular formula C17H17ClN2O2 and a molecular weight of 316.79 g/mol. Its IUPAC name is 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride.

Molecular Properties

Compound Name4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride
PubChem CID135802999
Molecular FormulaC17H17ClN2O2
Molecular Weight316.79 g/mol
Exact Mass316.10
IUPAC Name4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride
SMILESCOc1cccc(Nc2cc(C)nc3cc(O)ccc23)c1.Cl
InChIInChI=1S/C17H16N2O2.ClH/c1-11-8-16(15-7-6-13(20)10-17(15)18-11)19-12-4-3-5-14(9-12)21-2;/h3-10,20H,1-2H3,(H,18,19);1H
InChIKeyWPVGFASDFISMSI-UHFFFAOYSA-N
XLogP4.42
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(3-methoxyanilino)-2-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

7-methoxy-2-methyl-N-(3-methylphenyl)quinolin-4-amine
CID 110435602
4-[(7-methoxy-2-methylquinolin-4-yl)amino]-3-methylphenol
CID 110435658
methyl 4-(3-methoxyanilino)-2-methylquinoline-6-carboxylate
CID 730949
N-(4-fluorophenyl)-7-methoxy-2-methylquinolin-4-amine
CID 110435606
N-(3,4-dimethoxyphenyl)-7-methoxy-2-methylquinolin-4-amine
CID 110435623
7-methoxy-N-(2-methoxyphenyl)-2-methylquinolin-4-amine
CID 110435616
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 692374
N-tert-butyl-7-methoxy-2-methylquinolin-4-amine
CID 110433200
4-[(2-methylquinolin-4-yl)amino]phenol
CID 939157
3-[(6-bromo-2-methylquinolin-4-yl)amino]phenol;hydrochloride
CID 52994929
[4-(3-methoxyanilino)-2-methylquinolin-6-yl]-pyrazin-2-ylmethanone;hydrochloride
CID 22417962
3-[(2-methylquinolin-4-yl)amino]benzoic acid
CID 43419955

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride?
The IUPAC name of 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride (CID 135802999) is 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride.
What is the SMILES notation for 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride?
The canonical SMILES for 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride is COc1cccc(Nc2cc(C)nc3cc(O)ccc23)c1.Cl.
What is the InChIKey of 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride?
The InChIKey is WPVGFASDFISMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2.ClH/c1-11-8-16(15-7-6-13(20)10-17(15)18-11)19-12-4-3-5-14(9-12)21-2;/h3-10,20H,1-2H3,(H,18,19);1H.
What are the key properties of 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride?
4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride has a molecular weight of 316.79 g/mol, XLogP of 4.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride is sourced from PubChem (CID 135802999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).