1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide

C19H16N2O4 — CID 164609124

IUPAC1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide
SMILESO=C(NO)c1cccc(C(=O)NOCc2cccc3ccccc23)c1
InChIInChI=1S/C19H16N2O4/c22-18(20-24)14-7-4-8-15(11-14)19(23)21-25-12-16-9-3-6-13-5-1-2-10-17(13)16/h1-11,24H,12H2,(H,20,22)(H,21,23)
InChIKeyKDOJJXCRYYLTSO-UHFFFAOYSA-N
MW336.35 g/mol
LogP2.82
Rot. Bonds5

About 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide

1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide (PubChem CID 164609124) has the molecular formula C19H16N2O4 and a molecular weight of 336.35 g/mol. Its IUPAC name is 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide
PubChem CID164609124
Molecular FormulaC19H16N2O4
Molecular Weight336.35 g/mol
Exact Mass336.11
IUPAC Name1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide
SMILESO=C(NO)c1cccc(C(=O)NOCc2cccc3ccccc23)c1
InChIInChI=1S/C19H16N2O4/c22-18(20-24)14-7-4-8-15(11-14)19(23)21-25-12-16-9-3-6-13-5-1-2-10-17(13)16/h1-11,24H,12H2,(H,20,22)(H,21,23)
InChIKeyKDOJJXCRYYLTSO-UHFFFAOYSA-N
XLogP2.82
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 52.82
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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Frequently Asked Questions

What is the IUPAC name of 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide?
The IUPAC name of 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide (CID 164609124) is 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide.
What is the SMILES notation for 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide?
The canonical SMILES for 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide is O=C(NO)c1cccc(C(=O)NOCc2cccc3ccccc23)c1.
What is the InChIKey of 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide?
The InChIKey is KDOJJXCRYYLTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4/c22-18(20-24)14-7-4-8-15(11-14)19(23)21-25-12-16-9-3-6-13-5-1-2-10-17(13)16/h1-11,24H,12H2,(H,20,22)(H,21,23).
What are the key properties of 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide?
1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide has a molecular weight of 336.35 g/mol, XLogP of 2.82, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-hydroxy-3-N-(naphthalen-1-ylmethoxy)benzene-1,3-dicarboxamide is sourced from PubChem (CID 164609124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).