2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium

C20H26N3O2+ — CID 2221445

IUPAC2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium
SMILESCC[NH+](CC)CCNC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C20H25N3O2/c1-3-23(4-2)15-14-21-20(25)17-12-8-9-13-18(17)22-19(24)16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3,(H,21,25)(H,22,24)/p+1
InChIKeyPTEIGRLMDXADQZ-UHFFFAOYSA-O
MW340.45 g/mol
LogP1.59
Rot. Bonds8

About 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium

2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium (PubChem CID 2221445) has the molecular formula C20H26N3O2+ and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium.

Molecular Properties

Compound Name2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium
PubChem CID2221445
Molecular FormulaC20H26N3O2+
Molecular Weight340.45 g/mol
Exact Mass340.20
IUPAC Name2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium
SMILESCC[NH+](CC)CCNC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C20H25N3O2/c1-3-23(4-2)15-14-21-20(25)17-12-8-9-13-18(17)22-19(24)16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3,(H,21,25)(H,22,24)/p+1
InChIKeyPTEIGRLMDXADQZ-UHFFFAOYSA-O
XLogP1.59
TPSA62.64 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

diethyl-[2-[[2-(propan-2-yloxycarbonylamino)benzoyl]amino]ethyl]azanium chloride
CID 15944
2-benzamido-N-[2-(2-methylpropanoylamino)ethyl]benzamide
CID 30548525
2-benzamido-N-(3-butoxypropyl)benzamide
CID 30748297
N-ethyl-2-[(4-phenylbenzoyl)amino]benzamide
CID 4949283
2-benzamido-N-[(2-methylphenyl)methyl]benzamide
CID 9488926
2-[(3-fluorobenzoyl)amino]-N-propylbenzamide
CID 8002041
2-benzamido-N-[2-(2-methoxyphenoxy)ethyl]benzamide
CID 26549757
3,5-difluoro-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 8750781
3-benzamido-4-methyl-N-[2-(2-phenylethylcarbamoyl)phenyl]benzamide
CID 46410067
methyl 4-[[2-(2-phenylethylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17178238
2-benzamido-N-[2-(3,4-dihydroxyphenyl)ethyl]benzamide
CID 78799601
2-[(4-ethylbenzoyl)amino]-N-(2-phenoxyethyl)benzamide
CID 5298546

Frequently Asked Questions

What is the IUPAC name of 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium?
The IUPAC name of 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium (CID 2221445) is 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium.
What is the SMILES notation for 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium?
The canonical SMILES for 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium is CC[NH+](CC)CCNC(=O)c1ccccc1NC(=O)c1ccccc1.
What is the InChIKey of 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium?
The InChIKey is PTEIGRLMDXADQZ-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H25N3O2/c1-3-23(4-2)15-14-21-20(25)17-12-8-9-13-18(17)22-19(24)16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3,(H,21,25)(H,22,24)/p+1.
What are the key properties of 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium?
2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium has a molecular weight of 340.45 g/mol, XLogP of 1.59, 8 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-benzamidobenzoyl)amino]ethyl-diethylazanium is sourced from PubChem (CID 2221445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).