2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide

C11H22N2O2 — CID 112730307

IUPAC2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCC1CCOC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)13-7-10(14)12-6-9-4-5-15-8-9/h9,13H,4-8H2,1-3H3,(H,12,14)
InChIKeyLCPVZEFOQDFQAO-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.53
Rot. Bonds4

About 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide

2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide (PubChem CID 112730307) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide
PubChem CID112730307
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide
SMILESCC(C)(C)NCC(=O)NCC1CCOC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)13-7-10(14)12-6-9-4-5-15-8-9/h9,13H,4-8H2,1-3H3,(H,12,14)
InChIKeyLCPVZEFOQDFQAO-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylamino)-N-(oxolan-3-ylmethyl)acetamide
CID 60920124
N-(oxolan-3-ylmethyl)but-2-enamide
CID 112727361
2-amino-2-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 79797743
2-methyl-N-(oxolan-3-ylmethyl)propanamide
CID 60757135
6-oxo-6-(oxolan-3-ylmethylamino)hexanoic acid
CID 60919659
4-amino-3-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 81075819
3,3-dimethyl-2-(oxolan-3-ylmethylcarbamoyl)butanoic acid
CID 116537103
2-oxo-2-(oxolan-3-ylmethylamino)acetic acid
CID 62824224
2-methyl-4-oxo-4-(oxolan-3-ylmethylamino)-2-phenylbutanoic acid
CID 60919544
2-methyl-2-(oxolan-3-ylmethylamino)butanoic acid
CID 78969295
3-amino-3-hydroxyimino-2,2-dimethyl-N-(oxolan-3-ylmethyl)propanamide
CID 76950134
4-amino-3-methoxy-N-(oxolan-3-ylmethyl)butanamide
CID 103154885

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide (CID 112730307) is 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide is CC(C)(C)NCC(=O)NCC1CCOC1.
What is the InChIKey of 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide?
The InChIKey is LCPVZEFOQDFQAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,3)13-7-10(14)12-6-9-4-5-15-8-9/h9,13H,4-8H2,1-3H3,(H,12,14).
What are the key properties of 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide?
2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-(oxolan-3-ylmethyl)acetamide is sourced from PubChem (CID 112730307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).