N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide

C12H23NO2 — CID 131997480

IUPACN-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)N(O)CC1CCCC1
InChIInChI=1S/C12H23NO2/c1-4-12(2,3)11(14)13(15)9-10-7-5-6-8-10/h10,15H,4-9H2,1-3H3
InChIKeyFZINJMLFZMMHQM-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.83
Rot. Bonds4

About N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide

N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide (PubChem CID 131997480) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide
PubChem CID131997480
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)N(O)CC1CCCC1
InChIInChI=1S/C12H23NO2/c1-4-12(2,3)11(14)13(15)9-10-7-5-6-8-10/h10,15H,4-9H2,1-3H3
InChIKeyFZINJMLFZMMHQM-UHFFFAOYSA-N
XLogP2.83
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide?
The IUPAC name of N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide (CID 131997480) is N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide.
What is the SMILES notation for N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide?
The canonical SMILES for N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide is CCC(C)(C)C(=O)N(O)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide?
The InChIKey is FZINJMLFZMMHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-4-12(2,3)11(14)13(15)9-10-7-5-6-8-10/h10,15H,4-9H2,1-3H3.
What are the key properties of N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide?
N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide has a molecular weight of 213.32 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-hydroxy-2,2-dimethylbutanamide is sourced from PubChem (CID 131997480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).