N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide

C28H29N3O4 — CID 148814669

IUPACN-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide
SMILESCNC(=O)c1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1
InChIInChI=1S/C28H29N3O4/c1-29-28(34)24-12-11-23(18-25(24)30-27(33)19-31-13-15-35-16-14-31)26(32)17-20-7-9-22(10-8-20)21-5-3-2-4-6-21/h2-12,18H,13-17,19H2,1H3,(H,29,34)(H,30,33)
InChIKeyOQPIBJLNJFJYAI-UHFFFAOYSA-N
MW471.56 g/mol
LogP3.41
Rot. Bonds8

About N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide

N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide (PubChem CID 148814669) has the molecular formula C28H29N3O4 and a molecular weight of 471.56 g/mol. Its IUPAC name is N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide.

Molecular Properties

Compound NameN-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide
PubChem CID148814669
Molecular FormulaC28H29N3O4
Molecular Weight471.56 g/mol
Exact Mass471.22
IUPAC NameN-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide
SMILESCNC(=O)c1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1
InChIInChI=1S/C28H29N3O4/c1-29-28(34)24-12-11-23(18-25(24)30-27(33)19-31-13-15-35-16-14-31)26(32)17-20-7-9-22(10-8-20)21-5-3-2-4-6-21/h2-12,18H,13-17,19H2,1H3,(H,29,34)(H,30,33)
InChIKeyOQPIBJLNJFJYAI-UHFFFAOYSA-N
XLogP3.41
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.56
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide
CID 161191064
4-methylsulfanyl-3-[(2-morpholin-4-ylacetyl)amino]-N-(4-phenylphenyl)benzamide
CID 86299107
2-morpholin-4-yl-N-[5-[2-(4-pyrimidin-5-ylphenyl)acetyl]-2-(trifluoromethoxy)phenyl]acetamide
CID 160927857
N-[2-hydroxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-1-morpholin-4-ylcyclopropane-1-carboxamide
CID 148500321
1-N-(3-methoxypropyl)-2-[(2-morpholin-4-ylacetyl)amino]-1-N-(4-phenylphenyl)benzene-1,4-dicarboxamide
CID 90460306
N-[2-methoxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 161110649
4-(3-methoxypropoxy)-3-[(2-morpholin-4-ylacetyl)amino]-N-(4-phenylphenyl)benzamide
CID 86298920
N-[2-methoxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylbutanamide
CID 162074516
N-[5-[2-[6-(2-fluorophenyl)-3-pyridinyl]acetyl]-2-methoxyphenyl]-2-morpholin-4-ylacetamide
CID 148797037
N-[5-[2-[4-(2-fluoro-3-pyridinyl)phenyl]acetyl]-2-(trifluoromethoxy)phenyl]-2-morpholin-4-ylacetamide
CID 160817530
4-(methylsulfonylmethyl)-3-[(2-morpholin-4-ylacetyl)amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
CID 90461315
N-(2-methylphenyl)-2-morpholin-4-ylacetamide
CID 744983

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide?
The IUPAC name of N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide (CID 148814669) is N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide.
What is the SMILES notation for N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide?
The canonical SMILES for N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide is CNC(=O)c1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1.
What is the InChIKey of N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide?
The InChIKey is OQPIBJLNJFJYAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N3O4/c1-29-28(34)24-12-11-23(18-25(24)30-27(33)19-31-13-15-35-16-14-31)26(32)17-20-7-9-22(10-8-20)21-5-3-2-4-6-21/h2-12,18H,13-17,19H2,1H3,(H,29,34)(H,30,33).
What are the key properties of N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide?
N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide has a molecular weight of 471.56 g/mol, XLogP of 3.41, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide is sourced from PubChem (CID 148814669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).