1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide

C18H15Cl2N3O3 — CID 102035452

IUPAC1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCOc1c(C(=O)N(C)C)c(=O)n(-c2ccc(Cl)cc2Cl)c2ncccc12
InChIInChI=1S/C18H15Cl2N3O3/c1-22(2)17(24)14-15(26-3)11-5-4-8-21-16(11)23(18(14)25)13-7-6-10(19)9-12(13)20/h4-9H,1-3H3
InChIKeyYWXVHOHZPBBDGO-UHFFFAOYSA-N
MW392.24 g/mol
LogP3.40
Rot. Bonds3

About 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide

1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 102035452) has the molecular formula C18H15Cl2N3O3 and a molecular weight of 392.24 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID102035452
Molecular FormulaC18H15Cl2N3O3
Molecular Weight392.24 g/mol
Exact Mass391.05
IUPAC Name1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCOc1c(C(=O)N(C)C)c(=O)n(-c2ccc(Cl)cc2Cl)c2ncccc12
InChIInChI=1S/C18H15Cl2N3O3/c1-22(2)17(24)14-15(26-3)11-5-4-8-21-16(11)23(18(14)25)13-7-6-10(19)9-12(13)20/h4-9H,1-3H3
InChIKeyYWXVHOHZPBBDGO-UHFFFAOYSA-N
XLogP3.40
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.24
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide (CID 102035452) is 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide is COc1c(C(=O)N(C)C)c(=O)n(-c2ccc(Cl)cc2Cl)c2ncccc12.
What is the InChIKey of 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is YWXVHOHZPBBDGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O3/c1-22(2)17(24)14-15(26-3)11-5-4-8-21-16(11)23(18(14)25)13-7-6-10(19)9-12(13)20/h4-9H,1-3H3.
What are the key properties of 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 392.24 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-4-methoxy-N,N-dimethyl-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 102035452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).