3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide

C24H24N2O4 — CID 134802561

IUPAC3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide
SMILESCOc1cccc(C(=O)NCCNC(=O)c2ccc(-c3cccc(OC)c3)cc2)c1
InChIInChI=1S/C24H24N2O4/c1-29-21-7-3-5-19(15-21)17-9-11-18(12-10-17)23(27)25-13-14-26-24(28)20-6-4-8-22(16-20)30-2/h3-12,15-16H,13-14H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyJUYTXGPLEBVHRE-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.53
Rot. Bonds8

About 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide

3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide (PubChem CID 134802561) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide
PubChem CID134802561
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide
SMILESCOc1cccc(C(=O)NCCNC(=O)c2ccc(-c3cccc(OC)c3)cc2)c1
InChIInChI=1S/C24H24N2O4/c1-29-21-7-3-5-19(15-21)17-9-11-18(12-10-17)23(27)25-13-14-26-24(28)20-6-4-8-22(16-20)30-2/h3-12,15-16H,13-14H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyJUYTXGPLEBVHRE-UHFFFAOYSA-N
XLogP3.53
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 40718395
N-[2-[(3-methoxybenzoyl)amino]ethyl]-3,4-dimethylbenzamide
CID 108539237
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
N-[2-(cyclopentylcarbamoylamino)ethyl]-4-(3-methoxyphenyl)benzamide
CID 134804028
N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 40718415
3-methoxy-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
CID 40718391
N-[2-[(4-methoxybenzoyl)amino]ethyl]-3-methylbenzamide
CID 108537853
N-(2-tert-butylsulfanylethyl)-3-methoxybenzamide
CID 71879808
2-chloro-N-[2-[(3-methoxybenzoyl)amino]ethyl]benzamide
CID 7354272
N-(6-bromohexyl)-3-methoxybenzamide
CID 114008510
3-methoxy-N-tridecylbenzamide
CID 139819898
3-methoxy-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 7761263

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide (CID 134802561) is 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide is COc1cccc(C(=O)NCCNC(=O)c2ccc(-c3cccc(OC)c3)cc2)c1.
What is the InChIKey of 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide?
The InChIKey is JUYTXGPLEBVHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-29-21-7-3-5-19(15-21)17-9-11-18(12-10-17)23(27)25-13-14-26-24(28)20-6-4-8-22(16-20)30-2/h3-12,15-16H,13-14H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide?
3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide has a molecular weight of 404.47 g/mol, XLogP of 3.53, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-[[4-(3-methoxyphenyl)benzoyl]amino]ethyl]benzamide is sourced from PubChem (CID 134802561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).