N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide

C11H21NO3 — CID 131997483

IUPACN-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCCC(C)(C)C(=O)N(O)CC1CCCO1
InChIInChI=1S/C11H21NO3/c1-4-11(2,3)10(13)12(14)8-9-6-5-7-15-9/h9,14H,4-8H2,1-3H3
InChIKeyXHPWKWDPSGIBMH-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.82
Rot. Bonds4

About N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide

N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide (PubChem CID 131997483) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide.

Molecular Properties

Compound NameN-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide
PubChem CID131997483
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCCC(C)(C)C(=O)N(O)CC1CCCO1
InChIInChI=1S/C11H21NO3/c1-4-11(2,3)10(13)12(14)8-9-6-5-7-15-9/h9,14H,4-8H2,1-3H3
InChIKeyXHPWKWDPSGIBMH-UHFFFAOYSA-N
XLogP1.82
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide
CID 131997480
3-chloro-2,2-dimethyl-N,N-bis(oxolan-2-ylmethyl)propanamide
CID 63666515
2-(ethylamino)-2-methyl-N,N-bis(oxolan-2-ylmethyl)propanamide
CID 62836813
N-ethyl-2,2,2-trifluoro-N-(oxolan-2-ylmethyl)acetamide
CID 62727320
N-ethyl-2-methyl-2-(methylamino)-N-(oxolan-2-ylmethyl)propanamide
CID 62846746
N-ethyl-2-(ethylamino)-2-methyl-N-(oxolan-2-ylmethyl)propanamide
CID 62835569
N-methyl-N-(oxolan-2-ylmethyl)carbamoyl chloride
CID 79887071
2-(aminomethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)butanamide
CID 113270028
2-methyl-2-[methyl(oxan-2-ylmethyl)amino]butanoic acid
CID 114996677
methyl(oxolan-2-ylmethyl)carbamic acid
CID 90935828
2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride
CID 119746358
1,3-dimethyl-1-(oxolan-2-ylmethyl)urea
CID 115590472

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The IUPAC name of N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide (CID 131997483) is N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide.
What is the SMILES notation for N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The canonical SMILES for N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide is CCC(C)(C)C(=O)N(O)CC1CCCO1.
What is the InChIKey of N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The InChIKey is XHPWKWDPSGIBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-4-11(2,3)10(13)12(14)8-9-6-5-7-15-9/h9,14H,4-8H2,1-3H3.
What are the key properties of N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide has a molecular weight of 215.29 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2,2-dimethyl-N-(oxolan-2-ylmethyl)butanamide is sourced from PubChem (CID 131997483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).