7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide

C19H23N3O — CID 112529239

IUPAC7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
SMILESCc1ccccc1CCNC(=O)c1cncc2c1CCN(C)C2
InChIInChI=1S/C19H23N3O/c1-14-5-3-4-6-15(14)7-9-21-19(23)18-12-20-11-16-13-22(2)10-8-17(16)18/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,23)
InChIKeyUOZFLPBOKJBMPK-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.35
Rot. Bonds4

About 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide

7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide (PubChem CID 112529239) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide.

Molecular Properties

Compound Name7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
PubChem CID112529239
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
SMILESCc1ccccc1CCNC(=O)c1cncc2c1CCN(C)C2
InChIInChI=1S/C19H23N3O/c1-14-5-3-4-6-15(14)7-9-21-19(23)18-12-20-11-16-13-22(2)10-8-17(16)18/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,23)
InChIKeyUOZFLPBOKJBMPK-UHFFFAOYSA-N
XLogP2.35
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide?
The IUPAC name of 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide (CID 112529239) is 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide.
What is the SMILES notation for 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide?
The canonical SMILES for 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide is Cc1ccccc1CCNC(=O)c1cncc2c1CCN(C)C2.
What is the InChIKey of 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide?
The InChIKey is UOZFLPBOKJBMPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-14-5-3-4-6-15(14)7-9-21-19(23)18-12-20-11-16-13-22(2)10-8-17(16)18/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,23).
What are the key properties of 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide?
7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[2-(2-methylphenyl)ethyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide is sourced from PubChem (CID 112529239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).