2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide

C15H16N2O2 — CID 25237720

IUPAC2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide
SMILESCC(C)(O)C(=O)N/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2/c1-15(2,19)14(18)17-16-10-11-7-8-12-5-3-4-6-13(12)9-11/h3-10,19H,1-2H3,(H,17,18)/b16-10+
InChIKeySYHSJLZTARWQHP-MHWRWJLKSA-N
MW256.31 g/mol
LogP2.06
Rot. Bonds3

About 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide

2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide (PubChem CID 25237720) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide
PubChem CID25237720
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide
SMILESCC(C)(O)C(=O)N/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2/c1-15(2,19)14(18)17-16-10-11-7-8-12-5-3-4-6-13(12)9-11/h3-10,19H,1-2H3,(H,17,18)/b16-10+
InChIKeySYHSJLZTARWQHP-MHWRWJLKSA-N
XLogP2.06
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide (CID 25237720) is 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide is CC(C)(O)C(=O)N/N=C/c1ccc2ccccc2c1.
What is the InChIKey of 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide?
The InChIKey is SYHSJLZTARWQHP-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-15(2,19)14(18)17-16-10-11-7-8-12-5-3-4-6-13(12)9-11/h3-10,19H,1-2H3,(H,17,18)/b16-10+.
What are the key properties of 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide?
2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide has a molecular weight of 256.31 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-[(E)-naphthalen-2-ylmethylideneamino]propanamide is sourced from PubChem (CID 25237720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).