2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide

C13H19N3O3 — CID 82723266

IUPAC2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide
SMILESCC(C)(C)ONC(=O)C(NC(N)=O)c1ccccc1
InChIInChI=1S/C13H19N3O3/c1-13(2,3)19-16-11(17)10(15-12(14)18)9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,16,17)(H3,14,15,18)
InChIKeyPVNWVOUOTBNBNS-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.24
Rot. Bonds4

About 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide

2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide (PubChem CID 82723266) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide
PubChem CID82723266
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide
SMILESCC(C)(C)ONC(=O)C(NC(N)=O)c1ccccc1
InChIInChI=1S/C13H19N3O3/c1-13(2,3)19-16-11(17)10(15-12(14)18)9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,16,17)(H3,14,15,18)
InChIKeyPVNWVOUOTBNBNS-UHFFFAOYSA-N
XLogP1.24
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(carbamoylamino)-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide
CID 106181018
2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-2-phenylacetamide
CID 43500841
3-[[2-(carbamoylamino)-2-phenylacetyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 66174600
2-(carbamoylamino)-2-phenyl-N-propylacetamide
CID 60723613
tert-butyl N-[2-(methoxyamino)-2-oxo-1-phenylethyl]carbamate
CID 110611851
(2S)-2-[[2-(carbamoylamino)-2-phenylacetyl]amino]-3-methylbutanoic acid
CID 61136132
2-cyano-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide
CID 107857017
2-(carbamoylamino)-N-[(2S)-2-hydroxypropyl]-2-phenylacetamide
CID 83030049
tert-butyl N-(2-hydrazinyl-2-oxo-1-phenylethyl)carbamate
CID 546260
2-(carbamoylamino)-N-[(2R)-2-hydroxypropyl]-2-phenylacetamide
CID 83031308
2-(carbamoylamino)-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide
CID 62521560
2-(carbamoylamino)-N-(4-hydroxybutyl)-2-phenylacetamide
CID 106842975

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide?
The IUPAC name of 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide (CID 82723266) is 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide.
What is the SMILES notation for 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide?
The canonical SMILES for 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide is CC(C)(C)ONC(=O)C(NC(N)=O)c1ccccc1.
What is the InChIKey of 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide?
The InChIKey is PVNWVOUOTBNBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-13(2,3)19-16-11(17)10(15-12(14)18)9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,16,17)(H3,14,15,18).
What are the key properties of 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide?
2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide has a molecular weight of 265.31 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-[(2-methylpropan-2-yl)oxy]-2-phenylacetamide is sourced from PubChem (CID 82723266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).