N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide

C19H19N3O5S — CID 172515933

IUPACN-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide
SMILESCOc1ccc2c(S(=O)(=O)c3ccc(C(C)(C)C(=O)NO)cc3)ccnc2n1
InChIInChI=1S/C19H19N3O5S/c1-19(2,18(23)22-24)12-4-6-13(7-5-12)28(25,26)15-10-11-20-17-14(15)8-9-16(21-17)27-3/h4-11,24H,1-3H3,(H,22,23)
InChIKeyRZOXLFLHWRYXDJ-UHFFFAOYSA-N
MW401.44 g/mol
LogP2.25
Rot. Bonds5

About N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide

N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide (PubChem CID 172515933) has the molecular formula C19H19N3O5S and a molecular weight of 401.44 g/mol. Its IUPAC name is N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide
PubChem CID172515933
Molecular FormulaC19H19N3O5S
Molecular Weight401.44 g/mol
Exact Mass401.10
IUPAC NameN-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide
SMILESCOc1ccc2c(S(=O)(=O)c3ccc(C(C)(C)C(=O)NO)cc3)ccnc2n1
InChIInChI=1S/C19H19N3O5S/c1-19(2,18(23)22-24)12-4-6-13(7-5-12)28(25,26)15-10-11-20-17-14(15)8-9-16(21-17)27-3/h4-11,24H,1-3H3,(H,22,23)
InChIKeyRZOXLFLHWRYXDJ-UHFFFAOYSA-N
XLogP2.25
TPSA118.48 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.44
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

N,2-dihydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)oxy]phenyl]acetamide
CID 172991567
2-[3-fluoro-4-[(7-methoxy-1,8-naphthyridin-4-yl)oxy]phenyl]-N-hydroxyacetamide
CID 172515971
N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110446407
4-(4-methoxyphenyl)sulfonyl-2,3-dimethylpyridine
CID 54189244
2-(4-methoxyphenyl)-2-methyl-N-pyrimidin-2-ylpropanamide
CID 110439569
2-(4-methoxyphenyl)-2-methyl-N-(2-methyl-4-pyridinyl)propanamide
CID 110439571
methyl 2-(6-methoxy-3-pyridinyl)-2-methylpropanoate
CID 150017667
N-hydroxy-4-[4-[(7-methoxy-1,8-naphthyridin-4-yl)amino]phenyl]oxane-4-carboxamide
CID 172515954
N-[7-methoxy-4-[(5-sulfamoyl-2-pyridinyl)methylamino]-1,8-naphthyridin-3-yl]cyclopropanecarboxamide
CID 167160749
2-methoxy-5-[[4-(sulfinatoamino)phenyl]methylamino]-1,8-naphthyridine
CID 155099868
4-methoxypyrimidine-2-sulfonic acid;hydrate
CID 174301054
2-methoxy-5-[4-[(sulfinoamino)methyl]phenyl]-1,8-naphthyridine
CID 154630885

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide?
The IUPAC name of N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide (CID 172515933) is N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide?
The canonical SMILES for N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide is COc1ccc2c(S(=O)(=O)c3ccc(C(C)(C)C(=O)NO)cc3)ccnc2n1.
What is the InChIKey of N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide?
The InChIKey is RZOXLFLHWRYXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O5S/c1-19(2,18(23)22-24)12-4-6-13(7-5-12)28(25,26)15-10-11-20-17-14(15)8-9-16(21-17)27-3/h4-11,24H,1-3H3,(H,22,23).
What are the key properties of N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide?
N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide has a molecular weight of 401.44 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[4-[(7-methoxy-1,8-naphthyridin-4-yl)sulfonyl]phenyl]-2-methylpropanamide is sourced from PubChem (CID 172515933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).