2-[tert-butylcarbamoyl(methyl)amino]acetamide

C8H17N3O2 — CID 115585542

IUPAC2-[tert-butylcarbamoyl(methyl)amino]acetamide
SMILESCN(CC(N)=O)C(=O)NC(C)(C)C
InChIInChI=1S/C8H17N3O2/c1-8(2,3)10-7(13)11(4)5-6(9)12/h5H2,1-4H3,(H2,9,12)(H,10,13)
InChIKeyGHYBLIZOCMQMLJ-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.09
Rot. Bonds2

About 2-[tert-butylcarbamoyl(methyl)amino]acetamide

2-[tert-butylcarbamoyl(methyl)amino]acetamide (PubChem CID 115585542) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-[tert-butylcarbamoyl(methyl)amino]acetamide.

Molecular Properties

Compound Name2-[tert-butylcarbamoyl(methyl)amino]acetamide
PubChem CID115585542
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-[tert-butylcarbamoyl(methyl)amino]acetamide
SMILESCN(CC(N)=O)C(=O)NC(C)(C)C
InChIInChI=1S/C8H17N3O2/c1-8(2,3)10-7(13)11(4)5-6(9)12/h5H2,1-4H3,(H2,9,12)(H,10,13)
InChIKeyGHYBLIZOCMQMLJ-UHFFFAOYSA-N
XLogP-0.09
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[tert-butylcarbamoyl(methyl)amino]acetamide?
The IUPAC name of 2-[tert-butylcarbamoyl(methyl)amino]acetamide (CID 115585542) is 2-[tert-butylcarbamoyl(methyl)amino]acetamide.
What is the SMILES notation for 2-[tert-butylcarbamoyl(methyl)amino]acetamide?
The canonical SMILES for 2-[tert-butylcarbamoyl(methyl)amino]acetamide is CN(CC(N)=O)C(=O)NC(C)(C)C.
What is the InChIKey of 2-[tert-butylcarbamoyl(methyl)amino]acetamide?
The InChIKey is GHYBLIZOCMQMLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-8(2,3)10-7(13)11(4)5-6(9)12/h5H2,1-4H3,(H2,9,12)(H,10,13).
What are the key properties of 2-[tert-butylcarbamoyl(methyl)amino]acetamide?
2-[tert-butylcarbamoyl(methyl)amino]acetamide has a molecular weight of 187.24 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butylcarbamoyl(methyl)amino]acetamide is sourced from PubChem (CID 115585542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).