N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide

C19H16N2O — CID 690771

IUPACN-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2cccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O/c1-14(22)21-18-11-9-17(10-12-18)20-13-16-7-4-6-15-5-2-3-8-19(15)16/h2-13H,1H3,(H,21,22)/b20-13+
InChIKeyRRRYZQUEZFIYCP-DEDYPNTBSA-N
MW288.35 g/mol
LogP4.55
Rot. Bonds3

About N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide

N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide (PubChem CID 690771) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide
PubChem CID690771
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC NameN-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2cccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O/c1-14(22)21-18-11-9-17(10-12-18)20-13-16-7-4-6-15-5-2-3-8-19(15)16/h2-13H,1H3,(H,21,22)/b20-13+
InChIKeyRRRYZQUEZFIYCP-DEDYPNTBSA-N
XLogP4.55
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide?
The IUPAC name of N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide (CID 690771) is N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide.
What is the SMILES notation for N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide?
The canonical SMILES for N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide is CC(=O)Nc1ccc(/N=C/c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide?
The InChIKey is RRRYZQUEZFIYCP-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H16N2O/c1-14(22)21-18-11-9-17(10-12-18)20-13-16-7-4-6-15-5-2-3-8-19(15)16/h2-13H,1H3,(H,21,22)/b20-13+.
What are the key properties of N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide?
N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide has a molecular weight of 288.35 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(naphthalen-1-ylmethylideneamino)phenyl]acetamide is sourced from PubChem (CID 690771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).