4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide

C28H21N3O — CID 71449507

IUPAC4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide
SMILESO=C(NCc1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc3cccnc3n2)cc1
InChIInChI=1S/C28H21N3O/c32-28(30-19-20-8-10-22(11-9-20)21-5-2-1-3-6-21)25-14-12-23(13-15-25)26-17-16-24-7-4-18-29-27(24)31-26/h1-18H,19H2,(H,30,32)
InChIKeyANDGFDRZMQRIEG-UHFFFAOYSA-N
MW415.50 g/mol
LogP5.89
Rot. Bonds5

About 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide

4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide (PubChem CID 71449507) has the molecular formula C28H21N3O and a molecular weight of 415.50 g/mol. Its IUPAC name is 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide
PubChem CID71449507
Molecular FormulaC28H21N3O
Molecular Weight415.50 g/mol
Exact Mass415.17
IUPAC Name4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide
SMILESO=C(NCc1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc3cccnc3n2)cc1
InChIInChI=1S/C28H21N3O/c32-28(30-19-20-8-10-22(11-9-20)21-5-2-1-3-6-21)25-14-12-23(13-15-25)26-17-16-24-7-4-18-29-27(24)31-26/h1-18H,19H2,(H,30,32)
InChIKeyANDGFDRZMQRIEG-UHFFFAOYSA-N
XLogP5.89
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.50
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-methylphenyl)methyl]-4-phenylbenzamide
CID 1228171
N-benzyl-4-[2-(benzylamino)pyrimidin-5-yl]benzamide
CID 53108687
N-[(4-pyridin-3-ylphenyl)methyl]-1,8-naphthyridine-3-carboxamide
CID 66633812
2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide
CID 46908965
N-(2-amino-3-pyridinyl)-4-[[(4-phenylphenyl)methylcarbamoylamino]methyl]benzamide
CID 44595113
N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]pyridine-4-carboxamide
CID 108739638
4-phenyl-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 46476162
2-(ethylamino)-N-[(4-phenylphenyl)methyl]pyrimidine-5-carboxamide
CID 72860213
N-[(4-methylphenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
CID 53149733
4-ethoxy-N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]benzamide
CID 54774049
N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide
CID 25153718
N-[(6-methoxy-3-pyridinyl)methyl]-4-phenylbenzamide
CID 24589971

Frequently Asked Questions

What is the IUPAC name of 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide?
The IUPAC name of 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide (CID 71449507) is 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide.
What is the SMILES notation for 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide?
The canonical SMILES for 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide is O=C(NCc1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc3cccnc3n2)cc1.
What is the InChIKey of 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide?
The InChIKey is ANDGFDRZMQRIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N3O/c32-28(30-19-20-8-10-22(11-9-20)21-5-2-1-3-6-21)25-14-12-23(13-15-25)26-17-16-24-7-4-18-29-27(24)31-26/h1-18H,19H2,(H,30,32).
What are the key properties of 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide?
4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide has a molecular weight of 415.50 g/mol, XLogP of 5.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,8-naphthyridin-2-yl)-N-[(4-phenylphenyl)methyl]benzamide is sourced from PubChem (CID 71449507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).