N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide

C18H12F3NO2 — CID 16572142

IUPACN-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1OC(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C18H12F3NO2/c19-18(20,21)24-16-8-4-3-7-15(16)22-17(23)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,22,23)
InChIKeyQATWPWXABVCUEC-UHFFFAOYSA-N
MW331.29 g/mol
LogP4.99
Rot. Bonds3

About N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide

N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide (PubChem CID 16572142) has the molecular formula C18H12F3NO2 and a molecular weight of 331.29 g/mol. Its IUPAC name is N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
PubChem CID16572142
Molecular FormulaC18H12F3NO2
Molecular Weight331.29 g/mol
Exact Mass331.08
IUPAC NameN-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1OC(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C18H12F3NO2/c19-18(20,21)24-16-8-4-3-7-15(16)22-17(23)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,22,23)
InChIKeyQATWPWXABVCUEC-UHFFFAOYSA-N
XLogP4.99
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.29
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-iodo-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 43034347
N-[2-(difluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 953096
3,5-dimethyl-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 16572159
N-(2-fluorophenyl)naphthalene-2-carboxamide
CID 883701
6-oxo-N-[2-(trifluoromethoxy)phenyl]-1H-pyridine-3-carboxamide
CID 28880165
4-nitro-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 788210
4-methyl-3-nitro-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 17396372
3-methyl-4-nitro-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 16960800
6-methyl-N-[2-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 18149472
N-(2-acetamidophenyl)naphthalene-2-carboxamide
CID 787693
3-(pyrrolidin-1-ylmethyl)-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 60560548
N-(2-methylphenyl)naphthalene-2-carboxamide
CID 790563

Frequently Asked Questions

What is the IUPAC name of N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide (CID 16572142) is N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide is O=C(Nc1ccccc1OC(F)(F)F)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide?
The InChIKey is QATWPWXABVCUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3NO2/c19-18(20,21)24-16-8-4-3-7-15(16)22-17(23)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,22,23).
What are the key properties of N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide?
N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide has a molecular weight of 331.29 g/mol, XLogP of 4.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 16572142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).