N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide

C28H20N2O2 — CID 5120135

IUPACN-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C28H20N2O2/c31-27(23-11-9-19-5-1-3-7-21(19)17-23)29-25-13-15-26(16-14-25)30-28(32)24-12-10-20-6-2-4-8-22(20)18-24/h1-18H,(H,29,31)(H,30,32)
InChIKeyOAJDYTDMHFMBFA-UHFFFAOYSA-N
MW416.48 g/mol
LogP6.50
Rot. Bonds4

About N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide

N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide (PubChem CID 5120135) has the molecular formula C28H20N2O2 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
PubChem CID5120135
Molecular FormulaC28H20N2O2
Molecular Weight416.48 g/mol
Exact Mass416.15
IUPAC NameN-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C28H20N2O2/c31-27(23-11-9-19-5-1-3-7-21(19)17-23)29-25-13-15-26(16-14-25)30-28(32)24-12-10-20-6-2-4-8-22(20)18-24/h1-18H,(H,29,31)(H,30,32)
InChIKeyOAJDYTDMHFMBFA-UHFFFAOYSA-N
XLogP6.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.48
LogP ≤ 56.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-formylphenyl)naphthalene-2-carboxamide
CID 87842384
N-(3,4-difluorophenyl)naphthalene-2-carboxamide
CID 7771728
6-(phenylcarbamoyl)naphthalene-2-carboxylic acid
CID 57390877
N-(4-carbamimidoylphenyl)naphthalene-2-carboxamide
CID 151305092
N-(4-ethoxyphenyl)naphthalene-2-carboxamide
CID 2600548
N-[4-(3-methylbutanoylamino)phenyl]naphthalene-2-carboxamide
CID 33026876
2-N-phenylnaphthalene-2,6-dicarboxamide
CID 57399617
4-[4-(naphthalen-2-ylcarbamoyl)phenyl]-N-phenylbenzamide
CID 170421564
N-(3-acetylphenyl)naphthalene-2-carboxamide
CID 2274462
N-naphthalen-2-yl-4-phenylbenzamide
CID 1228216
methyl 3-[4-(naphthalene-2-carbonylamino)phenyl]prop-2-enoate
CID 66958345
N-naphthalen-2-yl-1,3-benzodioxole-5-carboxamide
CID 959403

Frequently Asked Questions

What is the IUPAC name of N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide (CID 5120135) is N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide is O=C(Nc1ccc(NC(=O)c2ccc3ccccc3c2)cc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide?
The InChIKey is OAJDYTDMHFMBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20N2O2/c31-27(23-11-9-19-5-1-3-7-21(19)17-23)29-25-13-15-26(16-14-25)30-28(32)24-12-10-20-6-2-4-8-22(20)18-24/h1-18H,(H,29,31)(H,30,32).
What are the key properties of N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide?
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 6.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 5120135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).