N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide

C18H14FNO2 — CID 141440290

IUPACN-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C18H14FNO2/c1-22-17-15-5-3-2-4-12(15)6-11-16(17)18(21)20-14-9-7-13(19)8-10-14/h2-11H,1H3,(H,20,21)
InChIKeyKLLZCUBYXIEPDU-UHFFFAOYSA-N
MW295.31 g/mol
LogP4.24
Rot. Bonds3

About N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide

N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide (PubChem CID 141440290) has the molecular formula C18H14FNO2 and a molecular weight of 295.31 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide
PubChem CID141440290
Molecular FormulaC18H14FNO2
Molecular Weight295.31 g/mol
Exact Mass295.10
IUPAC NameN-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C18H14FNO2/c1-22-17-15-5-3-2-4-12(15)6-11-16(17)18(21)20-14-9-7-13(19)8-10-14/h2-11H,1H3,(H,20,21)
InChIKeyKLLZCUBYXIEPDU-UHFFFAOYSA-N
XLogP4.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide (CID 141440290) is N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide is COc1c(C(=O)Nc2ccc(F)cc2)ccc2ccccc12.
What is the InChIKey of N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide?
The InChIKey is KLLZCUBYXIEPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO2/c1-22-17-15-5-3-2-4-12(15)6-11-16(17)18(21)20-14-9-7-13(19)8-10-14/h2-11H,1H3,(H,20,21).
What are the key properties of N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide?
N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide has a molecular weight of 295.31 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide is sourced from PubChem (CID 141440290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).