N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide

C14H27NO2 — CID 58297303

IUPACN-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide
SMILESCN(C(=O)C[C@H]1CCOC1)C(C)(C)C(C)(C)C
InChIInChI=1S/C14H27NO2/c1-13(2,3)14(4,5)15(6)12(16)9-11-7-8-17-10-11/h11H,7-10H2,1-6H3/t11-/m1/s1
InChIKeyOLQFAWIOPYAYCL-LLVKDONJSA-N
MW241.37 g/mol
LogP2.70
Rot. Bonds3

About N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide

N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide (PubChem CID 58297303) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide
PubChem CID58297303
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide
SMILESCN(C(=O)C[C@H]1CCOC1)C(C)(C)C(C)(C)C
InChIInChI=1S/C14H27NO2/c1-13(2,3)14(4,5)15(6)12(16)9-11-7-8-17-10-11/h11H,7-10H2,1-6H3/t11-/m1/s1
InChIKeyOLQFAWIOPYAYCL-LLVKDONJSA-N
XLogP2.70
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,3-diethylpyrrolidin-1-yl)-2-[(3R)-oxolan-3-yl]ethanone
CID 124295121
N-methyl-2-(oxan-4-yl)-N-(2,3,3-trimethylbutan-2-yl)acetamide
CID 58297239
N-cyclopropyl-2-(oxolan-3-yl)-N-propylacetamide
CID 58375996
N-methyl-N-(2-methylbutan-2-yl)-2-(oxan-4-yl)acetamide
CID 68318039
N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide
CID 71244447
2-(4-methyloxan-4-yl)-1-[(2R)-2-methylpyrrolidin-1-yl]propan-1-one
CID 90247379
1-[(2R)-2,4-dimethylpyrrolidin-1-yl]-2-(4-methyloxan-4-yl)propan-1-one
CID 90247431
N-tert-butyl-N-methyl-2-(oxolan-3-yl)acetamide
CID 90731465
N-tert-butyl-N-methyl-2-(oxan-4-yl)acetamide
CID 91552738
N-(2,3-dimethylbutan-2-yl)-N-methyl-2-(oxan-4-yl)acetamide
CID 126515460
N-tert-butyl-N-methyl-2-[(3R)-oxolan-3-yl]acetamide
CID 126515538
2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide
CID 142563332

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide?
The IUPAC name of N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide (CID 58297303) is N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide.
What is the SMILES notation for N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide?
The canonical SMILES for N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide is CN(C(=O)C[C@H]1CCOC1)C(C)(C)C(C)(C)C.
What is the InChIKey of N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide?
The InChIKey is OLQFAWIOPYAYCL-LLVKDONJSA-N. The full InChI is InChI=1S/C14H27NO2/c1-13(2,3)14(4,5)15(6)12(16)9-11-7-8-17-10-11/h11H,7-10H2,1-6H3/t11-/m1/s1.
What are the key properties of N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide?
N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide has a molecular weight of 241.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3R)-oxolan-3-yl]-N-(2,3,3-trimethylbutan-2-yl)acetamide is sourced from PubChem (CID 58297303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).