N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide

C19H23N3O2 — CID 91917861

IUPACN-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide
SMILESCCOc1ccc2c(n1)CCN(C(=O)Nc1ccc(C)cc1C)C2
InChIInChI=1S/C19H23N3O2/c1-4-24-18-8-6-15-12-22(10-9-17(15)20-18)19(23)21-16-7-5-13(2)11-14(16)3/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,23)
InChIKeyWOLLWRQYWBGSHG-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.69
Rot. Bonds3

About N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide

N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide (PubChem CID 91917861) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide
PubChem CID91917861
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide
SMILESCCOc1ccc2c(n1)CCN(C(=O)Nc1ccc(C)cc1C)C2
InChIInChI=1S/C19H23N3O2/c1-4-24-18-8-6-15-12-22(10-9-17(15)20-18)19(23)21-16-7-5-13(2)11-14(16)3/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,23)
InChIKeyWOLLWRQYWBGSHG-UHFFFAOYSA-N
XLogP3.69
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide (CID 91917861) is N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide is CCOc1ccc2c(n1)CCN(C(=O)Nc1ccc(C)cc1C)C2.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide?
The InChIKey is WOLLWRQYWBGSHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-24-18-8-6-15-12-22(10-9-17(15)20-18)19(23)21-16-7-5-13(2)11-14(16)3/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,23).
What are the key properties of N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide?
N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-ethoxy-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide is sourced from PubChem (CID 91917861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).