2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide

C18H20N4O3 — CID 87148315

IUPAC2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide
SMILESO=C(NO)c1ccc2c(n1)CCN(C(=O)NCCc1ccccc1)C2
InChIInChI=1S/C18H20N4O3/c23-17(21-25)16-7-6-14-12-22(11-9-15(14)20-16)18(24)19-10-8-13-4-2-1-3-5-13/h1-7,25H,8-12H2,(H,19,24)(H,21,23)
InChIKeyXLVIYJAINMGCQD-UHFFFAOYSA-N
MW340.38 g/mol
LogP1.51
Rot. Bonds4

About 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide

2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide (PubChem CID 87148315) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide
PubChem CID87148315
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide
SMILESO=C(NO)c1ccc2c(n1)CCN(C(=O)NCCc1ccccc1)C2
InChIInChI=1S/C18H20N4O3/c23-17(21-25)16-7-6-14-12-22(11-9-15(14)20-16)18(24)19-10-8-13-4-2-1-3-5-13/h1-7,25H,8-12H2,(H,19,24)(H,21,23)
InChIKeyXLVIYJAINMGCQD-UHFFFAOYSA-N
XLogP1.51
TPSA94.56 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropanecarbonylamino)-N-(2-phenylethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxamide
CID 90525823
N-hydroxy-6-(3-methylpentanoyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
CID 147008290
N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
CID 88578268
4-phenyl-N-(2-phenylethyl)-7-thia-2,3,5,10-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),3,5-triene-10-carboxamide
CID 53080116
6-benzyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
CID 46839896
2-(oxolane-2-carbonylamino)-N-(2-phenylethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxamide
CID 90526295
N-[2-(4-pyrazol-1-ylphenyl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 16608941
N-(2-cyclopropyl-2-hydroxyethyl)-6-[2-(trifluoromethyl)benzoyl]-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
CID 16662646
3-(2-methoxyethyl)-N-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-10-carboxamide
CID 53140414
4-(cyclopentanecarbonyl)-N-(2-phenylethyl)piperazine-1-carboxamide
CID 23819080
N-(cyclopropylmethyl)-6-[2-fluoro-6-(trifluoromethyl)benzoyl]-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
CID 69401436
N-[2-[2-(4-aminophenyl)ethylamino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 119549138

Frequently Asked Questions

What is the IUPAC name of 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide (CID 87148315) is 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide is O=C(NO)c1ccc2c(n1)CCN(C(=O)NCCc1ccccc1)C2.
What is the InChIKey of 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide?
The InChIKey is XLVIYJAINMGCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3/c23-17(21-25)16-7-6-14-12-22(11-9-15(14)20-16)18(24)19-10-8-13-4-2-1-3-5-13/h1-7,25H,8-12H2,(H,19,24)(H,21,23).
What are the key properties of 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide?
2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide has a molecular weight of 340.38 g/mol, XLogP of 1.51, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-hydroxy-6-N-(2-phenylethyl)-7,8-dihydro-5H-1,6-naphthyridine-2,6-dicarboxamide is sourced from PubChem (CID 87148315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).