N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide

C24H26N2O5S — CID 1441376

IUPACN-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide
SMILESCCOc1cc(NC(=O)c2ccc(OC)cc2)c(OCC)cc1NC(=O)Cc1cccs1
InChIInChI=1S/C24H26N2O5S/c1-4-30-21-15-20(26-24(28)16-8-10-17(29-3)11-9-16)22(31-5-2)14-19(21)25-23(27)13-18-7-6-12-32-18/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyHDXRDCLLMYBVPL-UHFFFAOYSA-N
MW454.55 g/mol
LogP4.99
Rot. Bonds10

About N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide

N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide (PubChem CID 1441376) has the molecular formula C24H26N2O5S and a molecular weight of 454.55 g/mol. Its IUPAC name is N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide
PubChem CID1441376
Molecular FormulaC24H26N2O5S
Molecular Weight454.55 g/mol
Exact Mass454.16
IUPAC NameN-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide
SMILESCCOc1cc(NC(=O)c2ccc(OC)cc2)c(OCC)cc1NC(=O)Cc1cccs1
InChIInChI=1S/C24H26N2O5S/c1-4-30-21-15-20(26-24(28)16-8-10-17(29-3)11-9-16)22(31-5-2)14-19(21)25-23(27)13-18-7-6-12-32-18/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyHDXRDCLLMYBVPL-UHFFFAOYSA-N
XLogP4.99
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.55
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-hydroxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide
CID 6496844
4-methoxy-N-[3-methyl-4-[(2-thiophen-2-ylacetyl)amino]phenyl]benzamide
CID 17358957
4-chloro-N-(2-ethoxyphenyl)-3-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 56692214
4-methoxy-3-[(2-thiophen-2-ylacetyl)amino]benzoic acid
CID 63742917
N-[4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-2,5-diethoxyphenyl]thiophene-2-carboxamide
CID 3874381
N-(4-methoxyphenyl)-2-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 2975011
N-(2-chloro-4,5-dimethoxyphenyl)-2-thiophen-2-ylacetamide
CID 18139931
N-[4-[2-(2-ethoxyanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-methoxybenzamide
CID 26841919
N-(4-benzamido-2,5-diethoxyphenyl)benzamide
CID 1147279
4-chloro-N-[2-[(2-thiophen-2-ylacetyl)amino]phenyl]benzamide
CID 31970330
N-(4-benzamido-2,5-diethoxyphenyl)-4-(2,5-dimethoxybenzoyl)benzamide
CID 4025593
N-[2,5-diethoxy-4-[3-(4-methoxyphenyl)prop-2-enoylamino]phenyl]benzamide
CID 4642597

Frequently Asked Questions

What is the IUPAC name of N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide?
The IUPAC name of N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide (CID 1441376) is N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide.
What is the SMILES notation for N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide?
The canonical SMILES for N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide is CCOc1cc(NC(=O)c2ccc(OC)cc2)c(OCC)cc1NC(=O)Cc1cccs1.
What is the InChIKey of N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide?
The InChIKey is HDXRDCLLMYBVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O5S/c1-4-30-21-15-20(26-24(28)16-8-10-17(29-3)11-9-16)22(31-5-2)14-19(21)25-23(27)13-18-7-6-12-32-18/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,27)(H,26,28).
What are the key properties of N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide?
N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide has a molecular weight of 454.55 g/mol, XLogP of 4.99, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-4-methoxybenzamide is sourced from PubChem (CID 1441376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).