N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide

C18H14FNO — CID 91032994

IUPACN-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide
SMILESCc1cc2ccccc2cc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C18H14FNO/c1-12-10-13-4-2-3-5-14(13)11-17(12)18(21)20-16-8-6-15(19)7-9-16/h2-11H,1H3,(H,20,21)
InChIKeyWHQGXTAVKNBLFZ-UHFFFAOYSA-N
MW279.31 g/mol
LogP4.54
Rot. Bonds2

About N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide

N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide (PubChem CID 91032994) has the molecular formula C18H14FNO and a molecular weight of 279.31 g/mol. Its IUPAC name is N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide
PubChem CID91032994
Molecular FormulaC18H14FNO
Molecular Weight279.31 g/mol
Exact Mass279.11
IUPAC NameN-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide
SMILESCc1cc2ccccc2cc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C18H14FNO/c1-12-10-13-4-2-3-5-14(13)11-17(12)18(21)20-16-8-6-15(19)7-9-16/h2-11H,1H3,(H,20,21)
InChIKeyWHQGXTAVKNBLFZ-UHFFFAOYSA-N
XLogP4.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-N-phenylnaphthalene-2-carboxamide
CID 90742280
CID 146983467
CID 146983467
N-(4-chlorophenyl)-5-fluoro-2-methylbenzamide
CID 34753639
2-[(4-fluorobenzoyl)amino]-N-(4-methoxyphenyl)benzamide
CID 2227245
N-(4-fluorophenyl)-2-[(4-methoxybenzoyl)amino]benzamide
CID 1307045
2-fluoro-N-(4-fluorophenyl)-5-methylbenzamide
CID 62509352
N-(4-carbamoylphenyl)-4-fluoro-2-methylbenzamide
CID 115745097
N-(4-fluorophenyl)-1-methoxynaphthalene-2-carboxamide
CID 141440290
4-fluoro-2-hydroxy-N-naphthalen-2-ylbenzamide
CID 107015197
3-hydroxy-N-[4-(methylcarbamoyl)phenyl]naphthalene-2-carboxamide
CID 25469011
4-N-(4-fluorophenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046825
4-fluoro-N-[4-[(2-methylphenyl)methylamino]phenyl]benzamide
CID 112982011

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide (CID 91032994) is N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide is Cc1cc2ccccc2cc1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide?
The InChIKey is WHQGXTAVKNBLFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO/c1-12-10-13-4-2-3-5-14(13)11-17(12)18(21)20-16-8-6-15(19)7-9-16/h2-11H,1H3,(H,20,21).
What are the key properties of N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide?
N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide has a molecular weight of 279.31 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-3-methylnaphthalene-2-carboxamide is sourced from PubChem (CID 91032994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).