N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide

C26H22N2O2 — CID 140808958

IUPACN-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide
SMILESCc1ccc(-c2ccc(COc3ncccc3NC(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H22N2O2/c1-19-9-13-21(14-10-19)22-15-11-20(12-16-22)18-30-26-24(8-5-17-27-26)28-25(29)23-6-3-2-4-7-23/h2-17H,18H2,1H3,(H,28,29)
InChIKeySQAHWJTXQVDGEF-UHFFFAOYSA-N
MW394.47 g/mol
LogP5.89
Rot. Bonds6

About N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide

N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide (PubChem CID 140808958) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide
PubChem CID140808958
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC NameN-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide
SMILESCc1ccc(-c2ccc(COc3ncccc3NC(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H22N2O2/c1-19-9-13-21(14-10-19)22-15-11-20(12-16-22)18-30-26-24(8-5-17-27-26)28-25(29)23-6-3-2-4-7-23/h2-17H,18H2,1H3,(H,28,29)
InChIKeySQAHWJTXQVDGEF-UHFFFAOYSA-N
XLogP5.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.47
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(naphthalen-1-ylmethoxy)-3-pyridinyl]benzamide
CID 140808981
3-amino-N-(2-phenylmethoxy-3-pyridinyl)pyrazine-2-carboxamide
CID 136525909
3-benzamido-N-[2-(2-methoxyethoxy)-3-pyridinyl]-4-methylbenzamide
CID 56500125
N-(2-ethoxy-3-pyridinyl)-3-methoxy-4-phenylmethoxybenzamide
CID 34876331
1-(4-tert-butylphenyl)-3-(2-phenylmethoxy-3-pyridinyl)urea
CID 11509064
N-(5-bromoquinolin-8-yl)-4-[(4-methylphenoxy)methyl]benzamide
CID 126187586
4-[(4-methylphenoxy)methyl]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 3304613
N-[(4-methylphenyl)methoxy]benzamide
CID 2366824
N-(2,3-dimethylphenyl)-4-(phenoxymethyl)benzamide
CID 7946940
N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide
CID 34879256
3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958850
N-(2-amino-3-pyridinyl)-4-[[(4-phenylphenyl)methylcarbamoylamino]methyl]benzamide
CID 44595113

Frequently Asked Questions

What is the IUPAC name of N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide?
The IUPAC name of N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide (CID 140808958) is N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide.
What is the SMILES notation for N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide?
The canonical SMILES for N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide is Cc1ccc(-c2ccc(COc3ncccc3NC(=O)c3ccccc3)cc2)cc1.
What is the InChIKey of N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide?
The InChIKey is SQAHWJTXQVDGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c1-19-9-13-21(14-10-19)22-15-11-20(12-16-22)18-30-26-24(8-5-17-27-26)28-25(29)23-6-3-2-4-7-23/h2-17H,18H2,1H3,(H,28,29).
What are the key properties of N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide?
N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide has a molecular weight of 394.47 g/mol, XLogP of 5.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[4-(4-methylphenyl)phenyl]methoxy]-3-pyridinyl]benzamide is sourced from PubChem (CID 140808958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).