N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide

C20H18N2O2 — CID 903928

IUPACN-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide
SMILESCCC(=NNC(=O)c1cccc2ccccc12)c1ccc(O)cc1
InChIInChI=1S/C20H18N2O2/c1-2-19(15-10-12-16(23)13-11-15)21-22-20(24)18-9-5-7-14-6-3-4-8-17(14)18/h3-13,23H,2H2,1H3,(H,22,24)
InChIKeyNWWHFJMEGZLFRQ-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.09
Rot. Bonds4

About N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide

N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide (PubChem CID 903928) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide
PubChem CID903928
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide
SMILESCCC(=NNC(=O)c1cccc2ccccc12)c1ccc(O)cc1
InChIInChI=1S/C20H18N2O2/c1-2-19(15-10-12-16(23)13-11-15)21-22-20(24)18-9-5-7-14-6-3-4-8-17(14)18/h3-13,23H,2H2,1H3,(H,22,24)
InChIKeyNWWHFJMEGZLFRQ-UHFFFAOYSA-N
XLogP4.09
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135609434
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-2-methoxybenzamide
CID 135643099
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-2-naphthalen-1-ylacetamide
CID 135588935
N-(butan-2-ylideneamino)naphthalene-1-carboxamide
CID 4560020
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2-nitrobenzamide
CID 135899627
4-hydroxy-N-[1-(4-methylphenyl)propylideneamino]benzamide
CID 4622646
N-[1-(4-hydroxyphenyl)propylideneamino]-2-prop-2-enoxybenzamide
CID 4928957
N-[1-(4-chlorophenyl)propylideneamino]-2-hydroxybenzamide
CID 4608756
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide
CID 135720029
4-ethyl-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135673772
N-[4-[[(E)-1-(4-hydroxyphenyl)propylideneamino]carbamoyl]phenyl]-2-methylbenzamide
CID 135625816
2-methyl-N-[(Z)-1-phenylpropylideneamino]benzamide
CID 5391962

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide?
The IUPAC name of N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide (CID 903928) is N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide.
What is the SMILES notation for N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide?
The canonical SMILES for N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide is CCC(=NNC(=O)c1cccc2ccccc12)c1ccc(O)cc1.
What is the InChIKey of N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide?
The InChIKey is NWWHFJMEGZLFRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-2-19(15-10-12-16(23)13-11-15)21-22-20(24)18-9-5-7-14-6-3-4-8-17(14)18/h3-13,23H,2H2,1H3,(H,22,24).
What are the key properties of N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide?
N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-hydroxyphenyl)propylideneamino]naphthalene-1-carboxamide is sourced from PubChem (CID 903928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).