2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide

C19H14F2N2O3 — CID 87529553

IUPAC2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide
SMILESNC(=O)c1ccc2cc(C(=O)N(O)Cc3cc(F)cc(F)c3)ccc2c1
InChIInChI=1S/C19H14F2N2O3/c20-16-5-11(6-17(21)9-16)10-23(26)19(25)15-4-2-12-7-14(18(22)24)3-1-13(12)8-15/h1-9,26H,10H2,(H2,22,24)
InChIKeyDFFZVUFHSCTKRY-UHFFFAOYSA-N
MW356.33 g/mol
LogP3.25
Rot. Bonds4

About 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide

2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide (PubChem CID 87529553) has the molecular formula C19H14F2N2O3 and a molecular weight of 356.33 g/mol. Its IUPAC name is 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide
PubChem CID87529553
Molecular FormulaC19H14F2N2O3
Molecular Weight356.33 g/mol
Exact Mass356.10
IUPAC Name2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide
SMILESNC(=O)c1ccc2cc(C(=O)N(O)Cc3cc(F)cc(F)c3)ccc2c1
InChIInChI=1S/C19H14F2N2O3/c20-16-5-11(6-17(21)9-16)10-23(26)19(25)15-4-2-12-7-14(18(22)24)3-1-13(12)8-15/h1-9,26H,10H2,(H2,22,24)
InChIKeyDFFZVUFHSCTKRY-UHFFFAOYSA-N
XLogP3.25
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.33
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-N-[(3,5-dimethylphenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide
CID 25256226
2-N-benzyl-2-N-hydroxynaphthalene-2,6-dicarboxamide
CID 25256224
2-N-hydroxy-2-N-(2-methylbutyl)naphthalene-2,6-dicarboxamide
CID 87529599
3-(4-carbamoylphenyl)-N-hydroxy-N-[(4-methoxyphenyl)methyl]benzamide
CID 87467946
N-[(3-fluorophenyl)methyl]-N-methylnaphthalene-2-carboxamide
CID 26292158
3-(4-carbamoylphenyl)-N-hydroxy-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
CID 87469042
tetracene-2-carboxamide;hydrobromide
CID 22400124
1-N,4-N-dibenzyl-1-N,4-N-dihydroxybenzene-1,4-dicarboxamide
CID 20615921
4-[[(4-fluorophenyl)methyl-methylamino]methyl]benzamide
CID 47129744
4-amino-3-(3,5-difluorophenoxy)benzamide
CID 55189641
6-[(E)-2-[4-(aminomethyl)phenyl]ethenyl]naphthalene-2-carboxamide
CID 142645139
3-amino-4-[[(3-fluorophenyl)methyl-methylamino]methyl]benzamide
CID 43375822

Frequently Asked Questions

What is the IUPAC name of 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide?
The IUPAC name of 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide (CID 87529553) is 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide.
What is the SMILES notation for 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide?
The canonical SMILES for 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide is NC(=O)c1ccc2cc(C(=O)N(O)Cc3cc(F)cc(F)c3)ccc2c1.
What is the InChIKey of 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide?
The InChIKey is DFFZVUFHSCTKRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N2O3/c20-16-5-11(6-17(21)9-16)10-23(26)19(25)15-4-2-12-7-14(18(22)24)3-1-13(12)8-15/h1-9,26H,10H2,(H2,22,24).
What are the key properties of 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide?
2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide has a molecular weight of 356.33 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(3,5-difluorophenyl)methyl]-2-N-hydroxynaphthalene-2,6-dicarboxamide is sourced from PubChem (CID 87529553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).