6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol

C22H19N3O2 — CID 146475138

IUPAC6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
SMILESCOc1cc2cccnc2c(O)c1C(Nc1ccccn1)c1ccccc1
InChIInChI=1S/C22H19N3O2/c1-27-17-14-16-10-7-13-24-21(16)22(26)19(17)20(15-8-3-2-4-9-15)25-18-11-5-6-12-23-18/h2-14,20,26H,1H3,(H,23,25)
InChIKeyHNMWAFUGFJCYPZ-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.55
Rot. Bonds5

About 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol

6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol (PubChem CID 146475138) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol.

Molecular Properties

Compound Name6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
PubChem CID146475138
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
SMILESCOc1cc2cccnc2c(O)c1C(Nc1ccccn1)c1ccccc1
InChIInChI=1S/C22H19N3O2/c1-27-17-14-16-10-7-13-24-21(16)22(26)19(17)20(15-8-3-2-4-9-15)25-18-11-5-6-12-23-18/h2-14,20,26H,1H3,(H,23,25)
InChIKeyHNMWAFUGFJCYPZ-UHFFFAOYSA-N
XLogP4.55
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol 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-[(8-hydroxy-6-methoxyquinolin-7-yl)-phenylmethyl]furan-2-carboxamide
CID 146475079
7-[(R)-(3-bromo-4-methoxyphenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 26366116
7-[(3-methoxy-4-prop-2-enoxyphenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 2966384
5-methyl-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 147199836
7-[(S)-(3-bromo-4-hydroxy-5-methoxyphenyl)-(pyridin-2-ylamino)methyl]-5-chloroquinolin-8-ol
CID 2221429
7-[(3-bromo-4-hydroxy-5-methoxyphenyl)-(pyridin-2-ylamino)methyl]-5-chloroquinolin-8-ol
CID 2966018
5-chloro-7-[(4-hydroxy-3-iodo-5-methoxyphenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 2966011
7-[(4-chlorophenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 2895250
7-[(4-fluorophenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 2895950
4-[(8-hydroxyquinolin-7-yl)-(pyridin-2-ylamino)methyl]-N-methylbenzamide
CID 146475050
7-[(R)-(2-methoxyphenyl)-[(4-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol
CID 7500417
7-[(S)-(4-ethylphenyl)-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 1222215

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?
The IUPAC name of 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol (CID 146475138) is 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol.
What is the SMILES notation for 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?
The canonical SMILES for 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol is COc1cc2cccnc2c(O)c1C(Nc1ccccn1)c1ccccc1.
What is the InChIKey of 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?
The InChIKey is HNMWAFUGFJCYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-27-17-14-16-10-7-13-24-21(16)22(26)19(17)20(15-8-3-2-4-9-15)25-18-11-5-6-12-23-18/h2-14,20,26H,1H3,(H,23,25).
What are the key properties of 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?
6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol has a molecular weight of 357.41 g/mol, XLogP of 4.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol is sourced from PubChem (CID 146475138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).