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

C20H27N5O3 — CID 31134789

IUPAC6-methyl-5-[5-[(2S)-oxan-2-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([C@@H]3CCCCO3)n2)C1
InChIInChI=1S/C20H27N5O3/c1-3-8-21-20(26)25-9-7-15-14(12-25)11-22-13(2)17(15)18-23-19(28-24-18)16-6-4-5-10-27-16/h11,16H,3-10,12H2,1-2H3,(H,21,26)/t16-/m0/s1
InChIKeyIQVRWFRLDTZMBX-INIZCTEOSA-N
MW385.47 g/mol
LogP3.16
Rot. Bonds4

About 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

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 (PubChem CID 31134789) has the molecular formula C20H27N5O3 and a molecular weight of 385.47 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name6-methyl-5-[5-[(2S)-oxan-2-yl]-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
PubChem CID31134789
Molecular FormulaC20H27N5O3
Molecular Weight385.47 g/mol
Exact Mass385.21
IUPAC Name6-methyl-5-[5-[(2S)-oxan-2-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([C@@H]3CCCCO3)n2)C1
InChIInChI=1S/C20H27N5O3/c1-3-8-21-20(26)25-9-7-15-14(12-25)11-22-13(2)17(15)18-23-19(28-24-18)16-6-4-5-10-27-16/h11,16H,3-10,12H2,1-2H3,(H,21,26)/t16-/m0/s1
InChIKeyIQVRWFRLDTZMBX-INIZCTEOSA-N
XLogP3.16
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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCCNC(=O)N1CCc2c(cnc(C)c2-c2noc([C@@H]3CCCCO3)n2)C1.
What is the InChIKey of 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?
The InChIKey is IQVRWFRLDTZMBX-INIZCTEOSA-N. The full InChI is InChI=1S/C20H27N5O3/c1-3-8-21-20(26)25-9-7-15-14(12-25)11-22-13(2)17(15)18-23-19(28-24-18)16-6-4-5-10-27-16/h11,16H,3-10,12H2,1-2H3,(H,21,26)/t16-/m0/s1.
What are the key properties of 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?
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 has a molecular weight of 385.47 g/mol, XLogP of 3.16, 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-[(2S)-oxan-2-yl]-1,2,4-oxadiazol-3-yl]-N-propyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide is sourced from PubChem (CID 31134789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).