N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide

C22H29N3O2 — CID 54818841

IUPACN-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide
SMILESCCCN(CCC)CC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1
InChIInChI=1S/C22H29N3O2/c1-3-14-25(15-4-2)17-21(26)24-20-12-10-19(11-13-20)22(27)23-16-18-8-6-5-7-9-18/h5-13H,3-4,14-17H2,1-2H3,(H,23,27)(H,24,26)
InChIKeyYAOAOTWIARFMNA-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.68
Rot. Bonds10

About N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide

N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide (PubChem CID 54818841) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide
PubChem CID54818841
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC NameN-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide
SMILESCCCN(CCC)CC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1
InChIInChI=1S/C22H29N3O2/c1-3-14-25(15-4-2)17-21(26)24-20-12-10-19(11-13-20)22(27)23-16-18-8-6-5-7-9-18/h5-13H,3-4,14-17H2,1-2H3,(H,23,27)(H,24,26)
InChIKeyYAOAOTWIARFMNA-UHFFFAOYSA-N
XLogP3.68
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-4-[[2-(propanoylamino)acetyl]amino]benzamide
CID 86846187
4-[[2-[4-(benzylcarbamoyl)anilino]-2-oxoethyl]amino]-N-propylbenzamide
CID 54835804
1-N-benzyl-4-N-(4-ethylphenyl)benzene-1,4-dicarboxamide
CID 109046714
N-benzyl-2-[ethyl(propyl)amino]acetamide
CID 142231835
N-benzyl-4-[(4-propoxybenzoyl)amino]benzamide
CID 28639944
methyl N-[4-(benzylcarbamoyl)phenyl]carbamate
CID 803106
N-benzyl-4-(propylamino)benzamide
CID 62172438
N-benzyl-4-[(4-heptoxybenzoyl)amino]benzamide
CID 43887413
1-N-benzyl-4-N-(4-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 109046738
2-(dipropylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 109006608
N-benzyl-4-[[2-(4-ethoxyanilino)acetyl]amino]benzamide
CID 54810964
N-butyl-4-[[2-(diethylamino)acetyl]amino]benzamide
CID 54813570

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide?
The IUPAC name of N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide (CID 54818841) is N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide.
What is the SMILES notation for N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide?
The canonical SMILES for N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide is CCCN(CCC)CC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1.
What is the InChIKey of N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide?
The InChIKey is YAOAOTWIARFMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-3-14-25(15-4-2)17-21(26)24-20-12-10-19(11-13-20)22(27)23-16-18-8-6-5-7-9-18/h5-13H,3-4,14-17H2,1-2H3,(H,23,27)(H,24,26).
What are the key properties of N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide?
N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide has a molecular weight of 367.49 g/mol, XLogP of 3.68, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[[2-(dipropylamino)acetyl]amino]benzamide is sourced from PubChem (CID 54818841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).