6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide

C24H23N3O3 — CID 20946822

IUPAC6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccn(Cc3ccco3)c(=O)c2cc1C(=O)NCCCc1ccccc1
InChIInChI=1S/C24H23N3O3/c1-17-20(23(28)25-12-5-9-18-7-3-2-4-8-18)15-21-22(26-17)11-13-27(24(21)29)16-19-10-6-14-30-19/h2-4,6-8,10-11,13-15H,5,9,12,16H2,1H3,(H,25,28)
InChIKeyBMIACZRPMGADMR-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.71
Rot. Bonds7

About 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide

6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide (PubChem CID 20946822) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide
PubChem CID20946822
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC Name6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccn(Cc3ccco3)c(=O)c2cc1C(=O)NCCCc1ccccc1
InChIInChI=1S/C24H23N3O3/c1-17-20(23(28)25-12-5-9-18-7-3-2-4-8-18)15-21-22(26-17)11-13-27(24(21)29)16-19-10-6-14-30-19/h2-4,6-8,10-11,13-15H,5,9,12,16H2,1H3,(H,25,28)
InChIKeyBMIACZRPMGADMR-UHFFFAOYSA-N
XLogP3.71
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(furan-2-yl)propyl]-2-methyl-5-oxo-6-(pyridin-3-ylmethyl)-1,6-naphthyridine-3-carboxamide
CID 20946798
N-[(4-bromophenyl)methyl]-6-(furan-2-ylmethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 46339903
3-(4-ethylpiperazine-1-carbonyl)-6-(furan-2-ylmethyl)-2-methyl-1,6-naphthyridin-5-one
CID 46339897
6-benzyl-2-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-oxo-1,6-naphthyridine-3-carboxamide
CID 169248825
6-benzyl-N-(2,5-dimethylphenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 20947019
6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 46339999
6-[(3-fluorophenyl)methyl]-2-methyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-5-oxo-1,6-naphthyridine-3-carboxamide
CID 169248733
N-[(4-chlorophenyl)methyl]-6-(furan-2-ylmethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-2-methyl-5-oxo-6-(pyridin-3-ylmethyl)-1,6-naphthyridine-3-carboxamide;N-(4-fluorophenyl)-6-[2-[4-(methoxymethyl)phenyl]ethyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 160853592
2-methyl-5-oxo-N-(pyridin-2-ylmethyl)-6-(pyridin-3-ylmethyl)-1,6-naphthyridine-3-carboxamide
CID 169248748
ethyl 2-methyl-5-oxo-6-(2-phenylethyl)-1,6-naphthyridine-3-carboxylate
CID 14666346
6-benzyl-2-methyl-N-(3-methylsulfanylphenyl)-5-oxo-1,6-naphthyridine-3-carboxamide
CID 20947021
2-(furan-2-ylmethylamino)-6-methyl-N-(3-phenylpropyl)pyrimidine-4-carboxamide
CID 109326812

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide?
The IUPAC name of 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide (CID 20946822) is 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide is Cc1nc2ccn(Cc3ccco3)c(=O)c2cc1C(=O)NCCCc1ccccc1.
What is the InChIKey of 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide?
The InChIKey is BMIACZRPMGADMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-17-20(23(28)25-12-5-9-18-7-3-2-4-8-18)15-21-22(26-17)11-13-27(24(21)29)16-19-10-6-14-30-19/h2-4,6-8,10-11,13-15H,5,9,12,16H2,1H3,(H,25,28).
What are the key properties of 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide?
6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide has a molecular weight of 401.47 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-ylmethyl)-2-methyl-5-oxo-N-(3-phenylpropyl)-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 20946822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).