4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide

C22H22N2O2 — CID 112983237

IUPAC4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NCCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22N2O2/c1-26-21-13-7-18(8-14-21)22(25)24-20-11-9-19(10-12-20)23-16-15-17-5-3-2-4-6-17/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyHNWVOZLMZMUPQB-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.60
Rot. Bonds7

About 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide

4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide (PubChem CID 112983237) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
PubChem CID112983237
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NCCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22N2O2/c1-26-21-13-7-18(8-14-21)22(25)24-20-11-9-19(10-12-20)23-16-15-17-5-3-2-4-6-17/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyHNWVOZLMZMUPQB-UHFFFAOYSA-N
XLogP4.60
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
CID 112983238
4-[2-(4-methoxyphenyl)ethylamino]benzoic acid
CID 62231026
3-methoxy-N-[4-(3-phenylpropylamino)phenyl]benzamide
CID 112984743
4-[(2-anilino-2-oxoethyl)amino]-N-(4-methoxyphenyl)benzamide
CID 9083996
N-[4-(butylamino)phenyl]-4-methoxybenzamide
CID 112980225
1-N-[2-(4-fluorophenyl)ethyl]-4-N-(4-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109048012
N-[4-[[(4-methoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1246678
methyl 4-(2-phenylethylamino)benzoate
CID 43217242
3,4-difluoro-N-[4-(2-phenylethylamino)phenyl]benzamide
CID 112983258
N-[4-[(2-fluorophenyl)methylamino]phenyl]-4-methoxybenzamide
CID 112982380
2-(dimethylamino)-5-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 4638056
N-[4-[benzyl(ethyl)amino]phenyl]-4-methoxybenzamide
CID 112982849

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide (CID 112983237) is 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide is COc1ccc(C(=O)Nc2ccc(NCCc3ccccc3)cc2)cc1.
What is the InChIKey of 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide?
The InChIKey is HNWVOZLMZMUPQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-26-21-13-7-18(8-14-21)22(25)24-20-11-9-19(10-12-20)23-16-15-17-5-3-2-4-6-17/h2-14,23H,15-16H2,1H3,(H,24,25).
What are the key properties of 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide?
4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide has a molecular weight of 346.43 g/mol, XLogP of 4.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide is sourced from PubChem (CID 112983237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).