6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C34H38N8O5 — CID 158737251

IUPAC6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(O)c3)cnc21.NC(=O)N1CCCc2cc(-c3cncc(OCC4CCOCC4)c3)cnc21
InChIInChI=1S/C20H24N4O3.C14H14N4O2/c21-20(25)24-5-1-2-15-8-16(11-23-19(15)24)17-9-18(12-22-10-17)27-13-14-3-6-26-7-4-14;15-14(20)18-3-1-2-9-4-10(7-17-13(9)18)11-5-12(19)8-16-6-11/h8-12,14H,1-7,13H2,(H2,21,25);4-8,19H,1-3H2,(H2,15,20)
InChIKeyILVHTXNFFHNPQY-UHFFFAOYSA-N
MW638.73 g/mol
LogP4.46
Rot. Bonds5

About 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 158737251) has the molecular formula C34H38N8O5 and a molecular weight of 638.73 g/mol. Its IUPAC name is 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID158737251
Molecular FormulaC34H38N8O5
Molecular Weight638.73 g/mol
Exact Mass638.30
IUPAC Name6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(O)c3)cnc21.NC(=O)N1CCCc2cc(-c3cncc(OCC4CCOCC4)c3)cnc21
InChIInChI=1S/C20H24N4O3.C14H14N4O2/c21-20(25)24-5-1-2-15-8-16(11-23-19(15)24)17-9-18(12-22-10-17)27-13-14-3-6-26-7-4-14;15-14(20)18-3-1-2-9-4-10(7-17-13(9)18)11-5-12(19)8-16-6-11/h8-12,14H,1-7,13H2,(H2,21,25);4-8,19H,1-3H2,(H2,15,20)
InChIKeyILVHTXNFFHNPQY-UHFFFAOYSA-N
XLogP4.46
TPSA182.91 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms47
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500638.73
LogP ≤ 54.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

7-Pyridin-3-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 86305613
6-(5-Methoxy-pyridin-3-yl)-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid amide
CID 86305614
7-(5-Fluoro-3-pyridinyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 86305716
6-(5-phenoxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305907
6-[5-(1-Acetyl-piperidin-4-yloxy)-pyridin-3-yl]-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid amide
CID 117667099
6-[5-(Tetrahydro-pyran-4-ylmethoxy)-pyridin-3-yl]-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid amide
CID 117667268
6-[5-(1-acetylpiperidin-4-yl)oxy-3-pyridinyl]-7-methyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667358
6-[5-(pyridazin-3-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667465
6-[5-(1-acetylpiperidin-4-yl)oxy-3-pyridinyl]-5-chloro-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667467
6-[5-[(3R)-1-acetylpiperidin-3-yl]oxy-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667483
6-[5-[(3S)-1-acetylpiperidin-3-yl]oxy-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667522
6-[5-[3-(dimethylamino)propoxy]-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 117667589

Frequently Asked Questions

What is the IUPAC name of 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 158737251) is 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1CCCc2cc(-c3cncc(O)c3)cnc21.NC(=O)N1CCCc2cc(-c3cncc(OCC4CCOCC4)c3)cnc21.
What is the InChIKey of 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is ILVHTXNFFHNPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O3.C14H14N4O2/c21-20(25)24-5-1-2-15-8-16(11-23-19(15)24)17-9-18(12-22-10-17)27-13-14-3-6-26-7-4-14;15-14(20)18-3-1-2-9-4-10(7-17-13(9)18)11-5-12(19)8-16-6-11/h8-12,14H,1-7,13H2,(H2,21,25);4-8,19H,1-3H2,(H2,15,20).
What are the key properties of 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 638.73 g/mol, XLogP of 4.46, 5 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-hydroxy-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;6-[5-(oxan-4-ylmethoxy)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 158737251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).