N-(2,2-dimethyloxan-4-yl)butanamide

C11H21NO2 — CID 115563895

IUPACN-(2,2-dimethyloxan-4-yl)butanamide
SMILESCCCC(=O)NC1CCOC(C)(C)C1
InChIInChI=1S/C11H21NO2/c1-4-5-10(13)12-9-6-7-14-11(2,3)8-9/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyIQXLVXXIVUOZBH-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.86
Rot. Bonds3

About N-(2,2-dimethyloxan-4-yl)butanamide

N-(2,2-dimethyloxan-4-yl)butanamide (PubChem CID 115563895) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)butanamide.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)butanamide
PubChem CID115563895
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(2,2-dimethyloxan-4-yl)butanamide
SMILESCCCC(=O)NC1CCOC(C)(C)C1
InChIInChI=1S/C11H21NO2/c1-4-5-10(13)12-9-6-7-14-11(2,3)8-9/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyIQXLVXXIVUOZBH-UHFFFAOYSA-N
XLogP1.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide
CID 83033442
3-(4-aminophenoxy)-N-(2,2-dimethyloxan-4-yl)propanamide
CID 83034462
N-(2,2-dimethyloxan-4-yl)-2-(methylamino)propanamide
CID 83033010
N-(2,2-dimethyloxan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
CID 136517618
ethyl 2-[(2,2-dimethyloxan-4-yl)carbamoyl]-3,3-dimethylbutanoate
CID 116538247
N-(2,2-dimethyloxan-4-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114627965
2-[2-(aminomethyl)phenyl]-N-(2,2-dimethyloxan-4-yl)acetamide
CID 83028620
2-(aminomethyl)-N-(2,2-dimethyloxan-4-yl)-3-methylbutanamide
CID 83033230
N-butyl-2-[(2,2-dimethyloxan-4-yl)amino]acetamide
CID 83033491
4-amino-5-[(2,2-dimethyloxan-4-yl)amino]-5-oxopentanoic acid
CID 83032758
(2S)-2-[(2,2-dimethyloxan-4-yl)carbamoylamino]hexanoic acid
CID 107146447
N-(2,2-dimethyloxan-4-yl)-4-(ethylamino)benzamide
CID 83039025

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)butanamide?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)butanamide (CID 115563895) is N-(2,2-dimethyloxan-4-yl)butanamide.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)butanamide?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)butanamide is CCCC(=O)NC1CCOC(C)(C)C1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)butanamide?
The InChIKey is IQXLVXXIVUOZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-4-5-10(13)12-9-6-7-14-11(2,3)8-9/h9H,4-8H2,1-3H3,(H,12,13).
What are the key properties of N-(2,2-dimethyloxan-4-yl)butanamide?
N-(2,2-dimethyloxan-4-yl)butanamide has a molecular weight of 199.29 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)butanamide is sourced from PubChem (CID 115563895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).