N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide

C24H16N2O2 — CID 23879270

IUPACN-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1-c1nc2ccccc2o1)c1ccc2ccccc2c1
InChIInChI=1S/C24H16N2O2/c27-23(18-14-13-16-7-1-2-8-17(16)15-18)25-20-10-4-3-9-19(20)24-26-21-11-5-6-12-22(21)28-24/h1-15H,(H,25,27)
InChIKeyZQQLTEYVYDJNPC-UHFFFAOYSA-N
MW364.40 g/mol
LogP5.90
Rot. Bonds3

About N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide

N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide (PubChem CID 23879270) has the molecular formula C24H16N2O2 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide
PubChem CID23879270
Molecular FormulaC24H16N2O2
Molecular Weight364.40 g/mol
Exact Mass364.12
IUPAC NameN-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccccc1-c1nc2ccccc2o1)c1ccc2ccccc2c1
InChIInChI=1S/C24H16N2O2/c27-23(18-14-13-16-7-1-2-8-17(16)15-18)25-20-10-4-3-9-19(20)24-26-21-11-5-6-12-22(21)28-24/h1-15H,(H,25,27)
InChIKeyZQQLTEYVYDJNPC-UHFFFAOYSA-N
XLogP5.90
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.40
LogP ≤ 55.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[[2-(1,3-benzoxazol-2-yl)phenyl]carbamoyl]benzoate
CID 23934647
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxybenzamide
CID 1215864
N-[2-(1,3-benzothiazol-2-yl)phenyl]naphthalene-2-carboxamide
CID 3839053
4-nitro-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 3646590
N-[5-amino-2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-carboxamide
CID 143844182
(2R)-2-amino-N-[2-(1,3-benzoxazol-2-yl)phenyl]propanamide
CID 135030644
9,10-dioxo-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]anthracene-2-carboxamide
CID 143844115
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-nitrobenzamide
CID 3364996
N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-iodobenzamide
CID 4188409
3,5-dinitro-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 5048093
N-(2-benzo[g][1,3]benzoxazol-2-ylphenyl)-4-methoxybenzamide
CID 4086369
N-(2-benzo[g][1,3]benzoxazol-2-ylphenyl)-3-methoxybenzamide
CID 5113548

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide (CID 23879270) is N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide is O=C(Nc1ccccc1-c1nc2ccccc2o1)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide?
The InChIKey is ZQQLTEYVYDJNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2O2/c27-23(18-14-13-16-7-1-2-8-17(16)15-18)25-20-10-4-3-9-19(20)24-26-21-11-5-6-12-22(21)28-24/h1-15H,(H,25,27).
What are the key properties of N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide?
N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide has a molecular weight of 364.40 g/mol, XLogP of 5.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-benzoxazol-2-yl)phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 23879270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).