N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide

C18H18N2O2 — CID 2851357

IUPACN-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide
SMILESO=C(NN=C1CCCc2ccccc21)C(O)c1ccccc1
InChIInChI=1S/C18H18N2O2/c21-17(14-8-2-1-3-9-14)18(22)20-19-16-12-6-10-13-7-4-5-11-15(13)16/h1-5,7-9,11,17,21H,6,10,12H2,(H,20,22)
InChIKeyTWQZWFXUEHGDSY-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.58
Rot. Bonds3

About N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide

N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide (PubChem CID 2851357) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide
PubChem CID2851357
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide
SMILESO=C(NN=C1CCCc2ccccc21)C(O)c1ccccc1
InChIInChI=1S/C18H18N2O2/c21-17(14-8-2-1-3-9-14)18(22)20-19-16-12-6-10-13-7-4-5-11-15(13)16/h1-5,7-9,11,17,21H,6,10,12H2,(H,20,22)
InChIKeyTWQZWFXUEHGDSY-UHFFFAOYSA-N
XLogP2.58
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.58
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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Related Compounds

N-(cyclooctylideneamino)-2-hydroxy-2-phenylacetamide
CID 3659218
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-(2,6-dimethylanilino)propanamide
CID 3096488
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-2-phenylacetamide
CID 5395791
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxybenzamide
CID 4999116
2-N,5-N-bis(3,4-dihydro-2H-naphthalen-1-ylideneamino)furan-2,5-dicarboxamide
CID 3419131
2-chloro-N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]benzamide
CID 6536301
2-bromo-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide
CID 3411206
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]hexanamide
CID 6031534
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide
CID 6297520
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)heptanamide
CID 4097852
4-[(2E)-2-(6,7,8,9-tetrahydrobenzo[7]annulen-5-ylidene)hydrazinyl]benzoic acid
CID 9013002
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-(4-phenylmethoxyphenoxy)acetamide
CID 5191870

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide (CID 2851357) is N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide is O=C(NN=C1CCCc2ccccc21)C(O)c1ccccc1.
What is the InChIKey of N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide?
The InChIKey is TWQZWFXUEHGDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c21-17(14-8-2-1-3-9-14)18(22)20-19-16-12-6-10-13-7-4-5-11-15(13)16/h1-5,7-9,11,17,21H,6,10,12H2,(H,20,22).
What are the key properties of N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide?
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide has a molecular weight of 294.35 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 2851357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).