N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide

C28H24N2O4 — CID 169183147

IUPACN-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
SMILESCOc1cccc(Oc2ccccc2NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C28H24N2O4/c1-33-23-10-7-11-24(18-23)34-26-13-6-5-12-25(26)30-27(31)19-29-28(32)22-16-14-21(15-17-22)20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31)
InChIKeyMMTLZCDQVHFJLG-UHFFFAOYSA-N
MW452.51 g/mol
LogP5.52
Rot. Bonds8

About N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide

N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide (PubChem CID 169183147) has the molecular formula C28H24N2O4 and a molecular weight of 452.51 g/mol. Its IUPAC name is N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
PubChem CID169183147
Molecular FormulaC28H24N2O4
Molecular Weight452.51 g/mol
Exact Mass452.17
IUPAC NameN-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
SMILESCOc1cccc(Oc2ccccc2NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C28H24N2O4/c1-33-23-10-7-11-24(18-23)34-26-13-6-5-12-25(26)30-27(31)19-29-28(32)22-16-14-21(15-17-22)20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31)
InChIKeyMMTLZCDQVHFJLG-UHFFFAOYSA-N
XLogP5.52
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.51
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide 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

N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 36915136
4-bromo-N-[2-oxo-2-(2-phenoxyanilino)ethyl]benzamide
CID 112771581
N-[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 37013397
3-methoxy-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 40718395
N-[2-[2-(3-methoxy-5-methylphenoxy)anilino]-2-oxoethyl]naphthalene-1-carboxamide
CID 176939013
N-[2-(2-tert-butylanilino)-2-oxoethyl]-3-methoxybenzamide
CID 112997486
N-(2-methoxyphenyl)-2-(2-phenoxyanilino)acetamide
CID 7922855
3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
CID 46756320
4-chloro-N-[2-(2,4-dimethoxyanilino)-2-oxoethyl]benzamide
CID 27253344
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
1-N-(2-methoxyethyl)-4-N-(2-phenoxyphenyl)benzene-1,4-dicarboxamide
CID 109045227
N-[2-(2-chloroanilino)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 112997742

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide?
The IUPAC name of N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide (CID 169183147) is N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide.
What is the SMILES notation for N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide?
The canonical SMILES for N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide is COc1cccc(Oc2ccccc2NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide?
The InChIKey is MMTLZCDQVHFJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O4/c1-33-23-10-7-11-24(18-23)34-26-13-6-5-12-25(26)30-27(31)19-29-28(32)22-16-14-21(15-17-22)20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31).
What are the key properties of N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide?
N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide has a molecular weight of 452.51 g/mol, XLogP of 5.52, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide is sourced from PubChem (CID 169183147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).