4-ethoxynaphthalene-1-carboxamide;fluoromethane

C14H16FNO2 — CID 143061073

IUPAC4-ethoxynaphthalene-1-carboxamide;fluoromethane
SMILESCCOc1ccc(C(N)=O)c2ccccc12.CF
InChIInChI=1S/C13H13NO2.CH3F/c1-2-16-12-8-7-11(13(14)15)9-5-3-4-6-10(9)12;1-2/h3-8H,2H2,1H3,(H2,14,15);1H3
InChIKeyOZOXLCNOTOBPGF-UHFFFAOYSA-N
MW249.28 g/mol
LogP2.92
Rot. Bonds3

About 4-ethoxynaphthalene-1-carboxamide;fluoromethane

4-ethoxynaphthalene-1-carboxamide;fluoromethane (PubChem CID 143061073) has the molecular formula C14H16FNO2 and a molecular weight of 249.28 g/mol. Its IUPAC name is 4-ethoxynaphthalene-1-carboxamide;fluoromethane.

Molecular Properties

Compound Name4-ethoxynaphthalene-1-carboxamide;fluoromethane
PubChem CID143061073
Molecular FormulaC14H16FNO2
Molecular Weight249.28 g/mol
Exact Mass249.12
IUPAC Name4-ethoxynaphthalene-1-carboxamide;fluoromethane
SMILESCCOc1ccc(C(N)=O)c2ccccc12.CF
InChIInChI=1S/C13H13NO2.CH3F/c1-2-16-12-8-7-11(13(14)15)9-5-3-4-6-10(9)12;1-2/h3-8H,2H2,1H3,(H2,14,15);1H3
InChIKeyOZOXLCNOTOBPGF-UHFFFAOYSA-N
XLogP2.92
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.28
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-ethoxynaphthalene-1-carbonyl) 4-ethoxynaphthalene-1-carboxylate
CID 88736257
(3-aminophenyl)-(4-ethoxynaphthalen-1-yl)methanone
CID 82263187
2-ethoxy-3,4-dimethoxybenzamide
CID 141309813
2,4-diethoxybenzamide
CID 17145726
5-[(4-ethoxynaphthalene-1-carbothioyl)amino]pentanoic acid
CID 59052603
2-amino-3-ethoxybenzamide
CID 70121071
1-[4-(2-hydroxypropoxy)naphthalen-1-yl]propan-1-one
CID 3031026
4-chloro-2-ethoxybenzamide
CID 126998915
4-bromo-2-ethoxy-3-phenylbenzamide
CID 71304584
2,3,4-tridodecoxybenzamide
CID 172754331
2-(4-propanoylnaphthalen-1-yl)oxyacetic acid
CID 154198459
(4-ethoxynaphthalen-1-yl)-(1-pentylindol-3-yl)methanone
CID 45267043

Frequently Asked Questions

What is the IUPAC name of 4-ethoxynaphthalene-1-carboxamide;fluoromethane?
The IUPAC name of 4-ethoxynaphthalene-1-carboxamide;fluoromethane (CID 143061073) is 4-ethoxynaphthalene-1-carboxamide;fluoromethane.
What is the SMILES notation for 4-ethoxynaphthalene-1-carboxamide;fluoromethane?
The canonical SMILES for 4-ethoxynaphthalene-1-carboxamide;fluoromethane is CCOc1ccc(C(N)=O)c2ccccc12.CF.
What is the InChIKey of 4-ethoxynaphthalene-1-carboxamide;fluoromethane?
The InChIKey is OZOXLCNOTOBPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2.CH3F/c1-2-16-12-8-7-11(13(14)15)9-5-3-4-6-10(9)12;1-2/h3-8H,2H2,1H3,(H2,14,15);1H3.
What are the key properties of 4-ethoxynaphthalene-1-carboxamide;fluoromethane?
4-ethoxynaphthalene-1-carboxamide;fluoromethane has a molecular weight of 249.28 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxynaphthalene-1-carboxamide;fluoromethane is sourced from PubChem (CID 143061073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).