2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide

C15H23N3O2 — CID 46554777

IUPAC2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNC(=O)NCc1ccccc1
InChIInChI=1S/C15H23N3O2/c1-4-15(2,3)18-13(19)11-17-14(20)16-10-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H,18,19)(H2,16,17,20)
InChIKeyGVRAYPMGOXBOPW-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.79
Rot. Bonds6

About 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide

2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 46554777) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide
PubChem CID46554777
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNC(=O)NCc1ccccc1
InChIInChI=1S/C15H23N3O2/c1-4-15(2,3)18-13(19)11-17-14(20)16-10-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H,18,19)(H2,16,17,20)
InChIKeyGVRAYPMGOXBOPW-UHFFFAOYSA-N
XLogP1.79
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide 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

2-[[2-(benzylcarbamoylamino)acetyl]amino]acetic acid
CID 61181658
2-(benzylcarbamoylamino)-N-(4-tert-butylphenyl)acetamide
CID 24559411
1-benzyl-3-(2,3,3-trimethylbutan-2-yl)urea
CID 131211782
N-(2-methylbutan-2-yl)-3,3-diphenylpropanamide
CID 1292106
N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 36895898
1-benzyl-3-(2-methyl-2-phenylpropyl)urea
CID 38887064
4-[(benzylcarbamoylamino)methyl]benzoic acid
CID 61180965
1-[2-(aminomethyl)-2-ethylbutyl]-3-benzylurea
CID 106251034
N-(2-methylbutan-2-yl)-2-[(2-methyl-2-phenylpropyl)amino]acetamide
CID 60976584
2-[(4-methylphenyl)methylcarbamoylamino]-N-(2-phenylethyl)acetamide
CID 51530628
2-(benzylcarbamoylamino)-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 30905093
4-[[[2-(methylamino)-2-oxoethyl]carbamoylamino]methyl]benzoic acid
CID 61198185

Frequently Asked Questions

What is the IUPAC name of 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide (CID 46554777) is 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNC(=O)NCc1ccccc1.
What is the InChIKey of 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is GVRAYPMGOXBOPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-4-15(2,3)18-13(19)11-17-14(20)16-10-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H,18,19)(H2,16,17,20).
What are the key properties of 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide?
2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.79, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylcarbamoylamino)-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 46554777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).