6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide

C20H27N5O3 — CID 31005319

IUPAC6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
SMILESCCCNC(=O)N1CCc2c(cnc(C)c2-c2noc(C3CCOCC3)n2)C1
InChIInChI=1S/C20H27N5O3/c1-3-7-21-20(26)25-8-4-16-15(12-25)11-22-13(2)17(16)18-23-19(28-24-18)14-5-9-27-10-6-14/h11,14H,3-10,12H2,1-2H3,(H,21,26)
InChIKeyKVCNTTNWKUVDHA-UHFFFAOYSA-N
MW385.47 g/mol
LogP2.81
Rot. Bonds4

About 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide

6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide (PubChem CID 31005319) has the molecular formula C20H27N5O3 and a molecular weight of 385.47 g/mol. Its IUPAC name is 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
PubChem CID31005319
Molecular FormulaC20H27N5O3
Molecular Weight385.47 g/mol
Exact Mass385.21
IUPAC Name6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
SMILESCCCNC(=O)N1CCc2c(cnc(C)c2-c2noc(C3CCOCC3)n2)C1
InChIInChI=1S/C20H27N5O3/c1-3-7-21-20(26)25-8-4-16-15(12-25)11-22-13(2)17(16)18-23-19(28-24-18)14-5-9-27-10-6-14/h11,14H,3-10,12H2,1-2H3,(H,21,26)
InChIKeyKVCNTTNWKUVDHA-UHFFFAOYSA-N
XLogP2.81
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide with MolForge

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Related Compounds

6-methyl-5-[5-[(2S)-oxan-2-yl]-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
CID 31134789
[6-methyl-5-[5-(1-methylpiperidin-4-yl)-1,2,4-oxadiazol-3-yl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-phenylmethanone
CID 29086016
5-[5-(1,4-dioxan-2-yl)-1,2,4-oxadiazol-3-yl]-6-methyl-N-propan-2-yl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
CID 45229255
6-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-methyl-3,4-dihydro-1H-2,7-naphthyridine-2-carbonyl]-1H-pyridin-2-one
CID 29084262
cyclobutyl-[6-methyl-5-(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
CID 31162028
[6-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methanone
CID 29170270
[6-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-[1-(trifluoromethyl)cyclopropyl]methanone
CID 29152092
1-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanone
CID 56853671
1-[6-methyl-5-[5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]but-3-en-1-one
CID 29022242
2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]-N-propylpyrrolidine-1-carboxamide
CID 91918857
1-[5-[6-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-1H-2,7-naphthyridine-2-carbonyl]thiophen-2-yl]ethanone
CID 28739588
[6-methyl-5-[5-(1H-pyrrol-2-yl)-1,2,4-oxadiazol-3-yl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]-(1,2-oxazol-3-yl)methanone
CID 135889475

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide?
The IUPAC name of 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide (CID 31005319) is 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide?
The canonical SMILES for 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide is CCCNC(=O)N1CCc2c(cnc(C)c2-c2noc(C3CCOCC3)n2)C1.
What is the InChIKey of 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide?
The InChIKey is KVCNTTNWKUVDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5O3/c1-3-7-21-20(26)25-8-4-16-15(12-25)11-22-13(2)17(16)18-23-19(28-24-18)14-5-9-27-10-6-14/h11,14H,3-10,12H2,1-2H3,(H,21,26).
What are the key properties of 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide?
6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide is sourced from PubChem (CID 31005319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).