2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide

C20H19Cl2N3O2 — CID 22072227

IUPAC2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide
SMILESCc1nc2ccccc2c(OCc2c(Cl)cccc2Cl)c1N(C)C(=O)CN
InChIInChI=1S/C20H19Cl2N3O2/c1-12-19(25(2)18(26)10-23)20(13-6-3-4-9-17(13)24-12)27-11-14-15(21)7-5-8-16(14)22/h3-9H,10-11,23H2,1-2H3
InChIKeyHPADYPXHNMHRNX-UHFFFAOYSA-N
MW404.30 g/mol
LogP4.35
Rot. Bonds5

About 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide

2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide (PubChem CID 22072227) has the molecular formula C20H19Cl2N3O2 and a molecular weight of 404.30 g/mol. Its IUPAC name is 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide
PubChem CID22072227
Molecular FormulaC20H19Cl2N3O2
Molecular Weight404.30 g/mol
Exact Mass403.09
IUPAC Name2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide
SMILESCc1nc2ccccc2c(OCc2c(Cl)cccc2Cl)c1N(C)C(=O)CN
InChIInChI=1S/C20H19Cl2N3O2/c1-12-19(25(2)18(26)10-23)20(13-6-3-4-9-17(13)24-12)27-11-14-15(21)7-5-8-16(14)22/h3-9H,10-11,23H2,1-2H3
InChIKeyHPADYPXHNMHRNX-UHFFFAOYSA-N
XLogP4.35
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.30
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide 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

(2,6-dichlorophenyl)methyl 2-methylquinoline-4-carboxylate
CID 2432200
2-amino-N-[4-chloro-2-methoxy-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-N-methylacetamide
CID 54560515
3-[5-[[2-(carbamoylamino)acetyl]-methylamino]-3-[(2,6-dichlorophenyl)methoxy]-4-methoxy-2-methylquinolin-6-yl]-N,N-bis(2-methoxyethyl)benzamide
CID 67597774
2-amino-N-[2,4-dichloro-3-[(3-methylquinolin-8-yl)oxymethyl]phenyl]-N-methylacetamide
CID 67736035
2-amino-N-[2,4-dichloro-3-[(1,2-dimethylbenzimidazol-4-yl)oxymethyl]phenyl]-N-methylacetamide
CID 15462176
3-chloro-2-[(2,6-dichlorophenyl)methoxy]benzoic acid
CID 115955910
2-[2-[(2,6-dichlorophenyl)methoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid
CID 20989348
ethyl 4-[(3-chlorophenyl)methyl]-2-methylquinoline-3-carboxylate
CID 45142175
2-(2,6-dichlorophenoxy)ethyl 2-ethyl-4-methylquinoline-3-carboxylate
CID 7502470
(2,3-dimethylquinolin-4-yl)methanamine
CID 63346552
2-amino-N-[2,4-dichloro-3-[(2-methyl-1H-imidazol-5-yl)oxymethyl]phenyl]-N-methylacetamide
CID 57025898
ethyl 4-amino-5-chloro-2-methylquinoline-3-carboxylate
CID 11780400

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide?
The IUPAC name of 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide (CID 22072227) is 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide.
What is the SMILES notation for 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide?
The canonical SMILES for 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide is Cc1nc2ccccc2c(OCc2c(Cl)cccc2Cl)c1N(C)C(=O)CN.
What is the InChIKey of 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide?
The InChIKey is HPADYPXHNMHRNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19Cl2N3O2/c1-12-19(25(2)18(26)10-23)20(13-6-3-4-9-17(13)24-12)27-11-14-15(21)7-5-8-16(14)22/h3-9H,10-11,23H2,1-2H3.
What are the key properties of 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide?
2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide has a molecular weight of 404.30 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[(2,6-dichlorophenyl)methoxy]-2-methylquinolin-3-yl]-N-methylacetamide is sourced from PubChem (CID 22072227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).