N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide

C24H24N2O3 — CID 991033

IUPACN-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide
SMILESCOc1ccc(C(NC(=O)Cc2ccccc2)NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2O3/c1-29-21-14-12-20(13-15-21)24(25-22(27)16-18-8-4-2-5-9-18)26-23(28)17-19-10-6-3-7-11-19/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyYJSDMQHDAOUJBO-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.41
Rot. Bonds8

About N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide

N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide (PubChem CID 991033) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide
PubChem CID991033
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide
SMILESCOc1ccc(C(NC(=O)Cc2ccccc2)NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2O3/c1-29-21-14-12-20(13-15-21)24(25-22(27)16-18-8-4-2-5-9-18)26-23(28)17-19-10-6-3-7-11-19/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyYJSDMQHDAOUJBO-UHFFFAOYSA-N
XLogP3.41
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-(4-((Phenethylamino)methyl)phenoxy)benzamide
CID 44434950
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
4-methoxy-N-(2-oxo-2-phenylethyl)benzamide
CID 796649
3,4-Dimethoxy-N-(phenylmethyl)benzeneacetamide
CID 2253267
N-[1-(4-methoxyphenyl)ethyl]-3-phenylpropanamide
CID 2877039
N-(4-methoxyphenethyl)benzamide
CID 3083797
2,4(1H,3H)-Pyrimidinedione, dihydro-1-((4-methoxyphenyl)methyl)-
CID 148737
N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamide
CID 710674
N-[(4-methoxyphenyl)methyl]-4-methylbenzamide
CID 720058
1-Benzyl-3-[(4-methoxyphenyl)methyl]urea
CID 15323520
N-(4-methoxybenzyl)oleamide
CID 11502240
N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-methoxybenzamide hydrochloride
CID 14783871

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide?
The IUPAC name of N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide (CID 991033) is N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide?
The canonical SMILES for N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide is COc1ccc(C(NC(=O)Cc2ccccc2)NC(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide?
The InChIKey is YJSDMQHDAOUJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-29-21-14-12-20(13-15-21)24(25-22(27)16-18-8-4-2-5-9-18)26-23(28)17-19-10-6-3-7-11-19/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide?
N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide has a molecular weight of 388.47 g/mol, XLogP of 3.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide is sourced from PubChem (CID 991033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).