N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide

C14H14N4O3S — CID 88578268

IUPACN-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
SMILESCc1nc(C(=O)N2CCc3nc(C(=O)NO)ccc3C2)cs1
InChIInChI=1S/C14H14N4O3S/c1-8-15-12(7-22-8)14(20)18-5-4-10-9(6-18)2-3-11(16-10)13(19)17-21/h2-3,7,21H,4-6H2,1H3,(H,17,19)
InChIKeyXLNGNDJDMVSNHW-UHFFFAOYSA-N
MW318.36 g/mol
LogP1.16
Rot. Bonds2

About N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide

N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide (PubChem CID 88578268) has the molecular formula C14H14N4O3S and a molecular weight of 318.36 g/mol. Its IUPAC name is N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
PubChem CID88578268
Molecular FormulaC14H14N4O3S
Molecular Weight318.36 g/mol
Exact Mass318.08
IUPAC NameN-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide
SMILESCc1nc(C(=O)N2CCc3nc(C(=O)NO)ccc3C2)cs1
InChIInChI=1S/C14H14N4O3S/c1-8-15-12(7-22-8)14(20)18-5-4-10-9(6-18)2-3-11(16-10)13(19)17-21/h2-3,7,21H,4-6H2,1H3,(H,17,19)
InChIKeyXLNGNDJDMVSNHW-UHFFFAOYSA-N
XLogP1.16
TPSA95.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide?
The IUPAC name of N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide (CID 88578268) is N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide.
What is the SMILES notation for N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide?
The canonical SMILES for N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide is Cc1nc(C(=O)N2CCc3nc(C(=O)NO)ccc3C2)cs1.
What is the InChIKey of N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide?
The InChIKey is XLNGNDJDMVSNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3S/c1-8-15-12(7-22-8)14(20)18-5-4-10-9(6-18)2-3-11(16-10)13(19)17-21/h2-3,7,21H,4-6H2,1H3,(H,17,19).
What are the key properties of N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide?
N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide has a molecular weight of 318.36 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-(2-methyl-1,3-thiazole-4-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxamide is sourced from PubChem (CID 88578268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).