N-fluoro-N-phenylnaphthalene-1-carboxamide

C17H12FNO — CID 90862687

IUPACN-fluoro-N-phenylnaphthalene-1-carboxamide
SMILESO=C(c1cccc2ccccc12)N(F)c1ccccc1
InChIInChI=1S/C17H12FNO/c18-19(14-9-2-1-3-10-14)17(20)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H
InChIKeyCLCBIYXRIRLKNG-UHFFFAOYSA-N
MW265.29 g/mol
LogP4.37
Rot. Bonds2

About N-fluoro-N-phenylnaphthalene-1-carboxamide

N-fluoro-N-phenylnaphthalene-1-carboxamide (PubChem CID 90862687) has the molecular formula C17H12FNO and a molecular weight of 265.29 g/mol. Its IUPAC name is N-fluoro-N-phenylnaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-fluoro-N-phenylnaphthalene-1-carboxamide
PubChem CID90862687
Molecular FormulaC17H12FNO
Molecular Weight265.29 g/mol
Exact Mass265.09
IUPAC NameN-fluoro-N-phenylnaphthalene-1-carboxamide
SMILESO=C(c1cccc2ccccc12)N(F)c1ccccc1
InChIInChI=1S/C17H12FNO/c18-19(14-9-2-1-3-10-14)17(20)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H
InChIKeyCLCBIYXRIRLKNG-UHFFFAOYSA-N
XLogP4.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-N-[4-[hydroxy(naphthalene-1-carbonyl)amino]phenyl]naphthalene-1-carboxamide
CID 56977411
[N-(naphthalene-1-carbonyl)anilino] naphthalene-1-carboxylate
CID 86093382
N-(2-cyanoethyl)-N-phenylnaphthalene-1-carboxamide
CID 43823022
tris(naphthalene-1-carboxylic acid);phosphane
CID 172834804
N-[2-(dimethylamino)ethyl]-N-methylnaphthalene-1-carboxamide
CID 110483893
1,3-dinaphthalen-1-ylpropane-1,2,3-trione
CID 67892351
naphthalene-1-carbonyl iodide
CID 87393513
3-hydroxy-2-[naphthalene-1-carbonyl(trifluoromethyl)amino]propanoic acid
CID 70817547
N-benzyl-N-tert-butylnaphthalene-1-carboxamide
CID 10914114
methanolate;bis(naphthalene-1-carboxylic acid);titanium(2+)
CID 91869033
N-(2-bromobenzoyl)naphthalene-1-carbohydrazide
CID 23622739
naphthalen-1-yl-(4-phenylphenyl)methanone
CID 23218936

Frequently Asked Questions

What is the IUPAC name of N-fluoro-N-phenylnaphthalene-1-carboxamide?
The IUPAC name of N-fluoro-N-phenylnaphthalene-1-carboxamide (CID 90862687) is N-fluoro-N-phenylnaphthalene-1-carboxamide.
What is the SMILES notation for N-fluoro-N-phenylnaphthalene-1-carboxamide?
The canonical SMILES for N-fluoro-N-phenylnaphthalene-1-carboxamide is O=C(c1cccc2ccccc12)N(F)c1ccccc1.
What is the InChIKey of N-fluoro-N-phenylnaphthalene-1-carboxamide?
The InChIKey is CLCBIYXRIRLKNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO/c18-19(14-9-2-1-3-10-14)17(20)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H.
What are the key properties of N-fluoro-N-phenylnaphthalene-1-carboxamide?
N-fluoro-N-phenylnaphthalene-1-carboxamide has a molecular weight of 265.29 g/mol, XLogP of 4.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-N-phenylnaphthalene-1-carboxamide is sourced from PubChem (CID 90862687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).