2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide

C19H17Cl2N3O2 — CID 168867456

IUPAC2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide
SMILESCOc1cc(-c2ccc3nc(Cl)nc(Cl)c3c2)ccc1CC(=O)N(C)C
InChIInChI=1S/C19H17Cl2N3O2/c1-24(2)17(25)10-13-5-4-12(9-16(13)26-3)11-6-7-15-14(8-11)18(20)23-19(21)22-15/h4-9H,10H2,1-3H3
InChIKeyIZCWBHDLXIKWEA-UHFFFAOYSA-N
MW390.27 g/mol
LogP4.24
Rot. Bonds4

About 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide

2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide (PubChem CID 168867456) has the molecular formula C19H17Cl2N3O2 and a molecular weight of 390.27 g/mol. Its IUPAC name is 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide
PubChem CID168867456
Molecular FormulaC19H17Cl2N3O2
Molecular Weight390.27 g/mol
Exact Mass389.07
IUPAC Name2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide
SMILESCOc1cc(-c2ccc3nc(Cl)nc(Cl)c3c2)ccc1CC(=O)N(C)C
InChIInChI=1S/C19H17Cl2N3O2/c1-24(2)17(25)10-13-5-4-12(9-16(13)26-3)11-6-7-15-14(8-11)18(20)23-19(21)22-15/h4-9H,10H2,1-3H3
InChIKeyIZCWBHDLXIKWEA-UHFFFAOYSA-N
XLogP4.24
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.27
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide 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-[4-(4-bromo-2-methylquinolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide
CID 170555848
(2,4-dichloroquinazolin-6-yl) acetate
CID 101166088
2-(2-methoxy-4-phenylphenyl)acetic acid
CID 23503476
methyl 2-[4-(4-chlorophenyl)-2-methoxyphenyl]acetate
CID 12732375
(2,4-dichloroquinazolin-6-yl) carbonochloridate
CID 88765606
2-(2,4-dichloroquinazolin-6-yl)oxyacetamide
CID 59799617
7-bromo-2,4-dichloro-6-methoxyquinazoline
CID 155682427
2-(4-amino-2-chloro-3-methoxyphenyl)-N,N-dimethylacetamide
CID 130275786
propan-2-yl 2,4-dichloroquinazoline-6-carboxylate
CID 135395749
2-chloro-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine
CID 87481246
2-chloro-6-[(2,4-dimethoxyphenyl)methylamino]pyrimidine-4-carboxylic acid
CID 118425010
N-benzyl-2-(2,4-dimethoxyphenyl)-N-methylacetamide
CID 110767880

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide?
The IUPAC name of 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide (CID 168867456) is 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide is COc1cc(-c2ccc3nc(Cl)nc(Cl)c3c2)ccc1CC(=O)N(C)C.
What is the InChIKey of 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide?
The InChIKey is IZCWBHDLXIKWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2N3O2/c1-24(2)17(25)10-13-5-4-12(9-16(13)26-3)11-6-7-15-14(8-11)18(20)23-19(21)22-15/h4-9H,10H2,1-3H3.
What are the key properties of 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide?
2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide has a molecular weight of 390.27 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,4-dichloroquinazolin-6-yl)-2-methoxyphenyl]-N,N-dimethylacetamide is sourced from PubChem (CID 168867456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).