2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide

C13H19N3O3 — CID 43500841

IUPAC2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide
SMILESCC(C)(CO)NC(=O)C(NC(N)=O)c1ccccc1
InChIInChI=1S/C13H19N3O3/c1-13(2,8-17)16-11(18)10(15-12(14)19)9-6-4-3-5-7-9/h3-7,10,17H,8H2,1-2H3,(H,16,18)(H3,14,15,19)
InChIKeyNJUBWZLCHKCBEJ-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.28
Rot. Bonds5

About 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide

2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide (PubChem CID 43500841) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide
PubChem CID43500841
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide
SMILESCC(C)(CO)NC(=O)C(NC(N)=O)c1ccccc1
InChIInChI=1S/C13H19N3O3/c1-13(2,8-17)16-11(18)10(15-12(14)19)9-6-4-3-5-7-9/h3-7,10,17H,8H2,1-2H3,(H,16,18)(H3,14,15,19)
InChIKeyNJUBWZLCHKCBEJ-UHFFFAOYSA-N
XLogP0.28
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide?
The IUPAC name of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide (CID 43500841) is 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide.
What is the SMILES notation for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide?
The canonical SMILES for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide is CC(C)(CO)NC(=O)C(NC(N)=O)c1ccccc1.
What is the InChIKey of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide?
The InChIKey is NJUBWZLCHKCBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-13(2,8-17)16-11(18)10(15-12(14)19)9-6-4-3-5-7-9/h3-7,10,17H,8H2,1-2H3,(H,16,18)(H3,14,15,19).
What are the key properties of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide?
2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide has a molecular weight of 265.31 g/mol, XLogP of 0.28, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide is sourced from PubChem (CID 43500841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).