2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide

C10H17N3O2 — CID 104600446

IUPAC2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCc1ccno1
InChIInChI=1S/C10H17N3O2/c1-10(2,3)12-7-9(14)11-6-8-4-5-13-15-8/h4-5,12H,6-7H2,1-3H3,(H,11,14)
InChIKeyGAXDVGUBMJBBJL-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.68
Rot. Bonds4

About 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide

2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide (PubChem CID 104600446) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide
PubChem CID104600446
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCc1ccno1
InChIInChI=1S/C10H17N3O2/c1-10(2,3)12-7-9(14)11-6-8-4-5-13-15-8/h4-5,12H,6-7H2,1-3H3,(H,11,14)
InChIKeyGAXDVGUBMJBBJL-UHFFFAOYSA-N
XLogP0.68
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
1-tert-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415604
2-(ethylamino)-2-methyl-N-(1,2-oxazol-5-ylmethyl)propanamide
CID 106417135
3-amino-4,4-dimethyl-N-(1,2-oxazol-5-ylmethyl)pentanamide
CID 106417021
2-methyl-2-(1,2-oxazol-5-ylmethylcarbamoylamino)propanoic acid
CID 106420969
2-[[2-(1,2-oxazol-5-ylmethylcarbamoylamino)acetyl]amino]acetic acid
CID 106421005
2-(1,2-oxazol-5-ylmethylamino)-N-propylacetamide
CID 103605856
6-(1,2-oxazol-5-ylmethylamino)-6-oxohexanoic acid
CID 106414801
N-(cyanomethyl)-2-(1,2-oxazol-5-ylmethylamino)acetamide
CID 106417912
3-methyl-3-(1,2-oxazol-5-ylmethylcarbamoylamino)butanoic acid
CID 106421030
3,3-dimethyl-2-(1,2-oxazol-5-ylmethylcarbamoylamino)butanoic acid
CID 106421303
2-methyl-N-(1,2-oxazol-5-ylmethyl)-2-pyrrolidin-1-ylpropanamide
CID 119065059

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide (CID 104600446) is 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide is CC(C)(C)NCC(=O)NCc1ccno1.
What is the InChIKey of 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide?
The InChIKey is GAXDVGUBMJBBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-10(2,3)12-7-9(14)11-6-8-4-5-13-15-8/h4-5,12H,6-7H2,1-3H3,(H,11,14).
What are the key properties of 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide?
2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide has a molecular weight of 211.26 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-(1,2-oxazol-5-ylmethyl)acetamide is sourced from PubChem (CID 104600446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).