N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide

C25H23N3O3 — CID 22083450

IUPACN-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide
SMILESCOc1ccccc1OCc1ccccc1C(=O)Nc1ccc2nc(C)cc(N)c2c1
InChIInChI=1S/C25H23N3O3/c1-16-13-21(26)20-14-18(11-12-22(20)27-16)28-25(29)19-8-4-3-7-17(19)15-31-24-10-6-5-9-23(24)30-2/h3-14H,15H2,1-2H3,(H2,26,27)(H,28,29)
InChIKeySZUNTNRURPNUJO-UHFFFAOYSA-N
MW413.48 g/mol
LogP4.97
Rot. Bonds6

About N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide

N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide (PubChem CID 22083450) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide.

Molecular Properties

Compound NameN-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide
PubChem CID22083450
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC NameN-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide
SMILESCOc1ccccc1OCc1ccccc1C(=O)Nc1ccc2nc(C)cc(N)c2c1
InChIInChI=1S/C25H23N3O3/c1-16-13-21(26)20-14-18(11-12-22(20)27-16)28-25(29)19-8-4-3-7-17(19)15-31-24-10-6-5-9-23(24)30-2/h3-14H,15H2,1-2H3,(H2,26,27)(H,28,29)
InChIKeySZUNTNRURPNUJO-UHFFFAOYSA-N
XLogP4.97
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide 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-(4-amino-2-methylquinolin-6-yl)-2-[(2-nitrophenoxy)methyl]benzamide
CID 22083452
4-[[2-[(4-amino-2-methylquinolin-6-yl)carbamoyl]phenyl]methoxy]benzoic acid;hydrochloride
CID 69240476
N-(4-amino-2-methylquinolin-6-yl)-2-[(2-chloro-4-ethylphenoxy)methyl]benzamide;hydrochloride
CID 22397054
N-(4-amino-2-methylquinolin-6-yl)-2-[(3-fluorophenoxy)methyl]benzamide;hydrochloride
CID 22397066
[4-[[2-[(4-amino-2-methylquinolin-6-yl)carbamoyl]phenyl]methoxy]phenyl]methyl acetate;hydrochloride
CID 22397041
N-(4-amino-2-methylquinolin-6-yl)-2-[[4-(trifluoromethyl)phenoxy]methyl]benzamide;hydrochloride
CID 22397059
N-(4-amino-2-methylquinolin-6-yl)-2-benzylbenzamide
CID 10546941
N-(4-amino-2-methylquinolin-6-yl)-2-[(3-cyanophenoxy)methyl]benzamide
CID 22083457
N-(4-amino-2-methylquinolin-6-yl)-2-(4-phenylbutyl)benzamide;hydrochloride
CID 162308221
N-(4-amino-2-methylquinolin-6-yl)-2-[(4-chloroanilino)methyl]benzamide;dihydrochloride
CID 160523492
N-(4-amino-2-methylquinolin-6-yl)-2-[(4-chlorophenyl)sulfanylmethyl]benzamide
CID 22083465
N-(4-amino-2-ethylquinolin-6-yl)-2-[(2-chloro-4-ethylphenoxy)methyl]benzamide;ethane;hydrochloride
CID 159636156

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide?
The IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide (CID 22083450) is N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide.
What is the SMILES notation for N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide?
The canonical SMILES for N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide is COc1ccccc1OCc1ccccc1C(=O)Nc1ccc2nc(C)cc(N)c2c1.
What is the InChIKey of N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide?
The InChIKey is SZUNTNRURPNUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c1-16-13-21(26)20-14-18(11-12-22(20)27-16)28-25(29)19-8-4-3-7-17(19)15-31-24-10-6-5-9-23(24)30-2/h3-14H,15H2,1-2H3,(H2,26,27)(H,28,29).
What are the key properties of N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide?
N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide has a molecular weight of 413.48 g/mol, XLogP of 4.97, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylquinolin-6-yl)-2-[(2-methoxyphenoxy)methyl]benzamide is sourced from PubChem (CID 22083450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).