N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide

C30H34N2O5 — CID 161191064

IUPACN-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide
SMILESCOCCCOc1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1
InChIInChI=1S/C30H34N2O5/c1-35-16-5-17-37-29-13-12-26(21-27(29)31-30(34)22-32-14-18-36-19-15-32)28(33)20-23-8-10-25(11-9-23)24-6-3-2-4-7-24/h2-4,6-13,21H,5,14-20,22H2,1H3,(H,31,34)
InChIKeyUTSOVGOPABLPRZ-UHFFFAOYSA-N
MW502.61 g/mol
LogP4.47
Rot. Bonds12

About N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide

N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide (PubChem CID 161191064) has the molecular formula C30H34N2O5 and a molecular weight of 502.61 g/mol. Its IUPAC name is N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide
PubChem CID161191064
Molecular FormulaC30H34N2O5
Molecular Weight502.61 g/mol
Exact Mass502.25
IUPAC NameN-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide
SMILESCOCCCOc1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1
InChIInChI=1S/C30H34N2O5/c1-35-16-5-17-37-29-13-12-26(21-27(29)31-30(34)22-32-14-18-36-19-15-32)28(33)20-23-8-10-25(11-9-23)24-6-3-2-4-7-24/h2-4,6-13,21H,5,14-20,22H2,1H3,(H,31,34)
InChIKeyUTSOVGOPABLPRZ-UHFFFAOYSA-N
XLogP4.47
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.61
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-methoxypropoxy)-3-[(2-morpholin-4-ylacetyl)amino]-N-(4-phenylphenyl)benzamide
CID 86298920
N-methyl-2-[(2-morpholin-4-ylacetyl)amino]-4-[2-(4-phenylphenyl)acetyl]benzamide
CID 148814669
2-morpholin-4-yl-N-[5-[2-(4-pyrimidin-5-ylphenyl)acetyl]-2-(trifluoromethoxy)phenyl]acetamide
CID 160927857
N-[2-methoxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 161110649
N-[5-[2-[6-(2-fluorophenyl)-3-pyridinyl]acetyl]-2-methoxyphenyl]-2-morpholin-4-ylacetamide
CID 148797037
N-[2-methoxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylbutanamide
CID 162074516
N-[5-[2-[4-(2-fluoro-3-pyridinyl)phenyl]acetyl]-2-(trifluoromethoxy)phenyl]-2-morpholin-4-ylacetamide
CID 160817530
1-N-(3-methoxypropyl)-2-[(2-morpholin-4-ylacetyl)amino]-1-N-(4-phenylphenyl)benzene-1,4-dicarboxamide
CID 90460306
4-[4-(aminomethyl)phenyl]-N-[4-methoxy-3-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 90459335
N-(5-ethyl-2-methoxyphenyl)-2-morpholin-4-ylacetamide
CID 154733696
4-methylsulfanyl-3-[(2-morpholin-4-ylacetyl)amino]-N-(4-phenylphenyl)benzamide
CID 86299107
N-[2-hydroxy-5-[2-(4-phenylphenyl)acetyl]phenyl]-1-morpholin-4-ylcyclopropane-1-carboxamide
CID 148500321

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide (CID 161191064) is N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide is COCCCOc1ccc(C(=O)Cc2ccc(-c3ccccc3)cc2)cc1NC(=O)CN1CCOCC1.
What is the InChIKey of N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is UTSOVGOPABLPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H34N2O5/c1-35-16-5-17-37-29-13-12-26(21-27(29)31-30(34)22-32-14-18-36-19-15-32)28(33)20-23-8-10-25(11-9-23)24-6-3-2-4-7-24/h2-4,6-13,21H,5,14-20,22H2,1H3,(H,31,34).
What are the key properties of N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide?
N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 502.61 g/mol, XLogP of 4.47, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxypropoxy)-5-[2-(4-phenylphenyl)acetyl]phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 161191064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).