N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide

C19H18N2O3 — CID 14406202

IUPACN-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide
SMILESCN(O)C(=O)Cc1cccc(OCc2ccc3ccccc3n2)c1
InChIInChI=1S/C19H18N2O3/c1-21(23)19(22)12-14-5-4-7-17(11-14)24-13-16-10-9-15-6-2-3-8-18(15)20-16/h2-11,23H,12-13H2,1H3
InChIKeyDDUDJLAELMWWHY-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.20
Rot. Bonds5

About N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide

N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide (PubChem CID 14406202) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide
PubChem CID14406202
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide
SMILESCN(O)C(=O)Cc1cccc(OCc2ccc3ccccc3n2)c1
InChIInChI=1S/C19H18N2O3/c1-21(23)19(22)12-14-5-4-7-17(11-14)24-13-16-10-9-15-6-2-3-8-18(15)20-16/h2-11,23H,12-13H2,1H3
InChIKeyDDUDJLAELMWWHY-UHFFFAOYSA-N
XLogP3.20
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.20
H-Bond Donors ≤ 51
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 N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide?
The IUPAC name of N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide (CID 14406202) is N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide.
What is the SMILES notation for N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide?
The canonical SMILES for N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide is CN(O)C(=O)Cc1cccc(OCc2ccc3ccccc3n2)c1.
What is the InChIKey of N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide?
The InChIKey is DDUDJLAELMWWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-21(23)19(22)12-14-5-4-7-17(11-14)24-13-16-10-9-15-6-2-3-8-18(15)20-16/h2-11,23H,12-13H2,1H3.
What are the key properties of N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide?
N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide has a molecular weight of 322.36 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-methyl-2-[3-(quinolin-2-ylmethoxy)phenyl]acetamide is sourced from PubChem (CID 14406202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).