N-cyclopentyloxy-2,2-dimethylbutanamide

C11H21NO2 — CID 83205695

IUPACN-cyclopentyloxy-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)NOC1CCCC1
InChIInChI=1S/C11H21NO2/c1-4-11(2,3)10(13)12-14-9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyVNWVUVSNMXYUJE-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.41
Rot. Bonds4

About N-cyclopentyloxy-2,2-dimethylbutanamide

N-cyclopentyloxy-2,2-dimethylbutanamide (PubChem CID 83205695) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-cyclopentyloxy-2,2-dimethylbutanamide.

Molecular Properties

Compound NameN-cyclopentyloxy-2,2-dimethylbutanamide
PubChem CID83205695
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-cyclopentyloxy-2,2-dimethylbutanamide
SMILESCCC(C)(C)C(=O)NOC1CCCC1
InChIInChI=1S/C11H21NO2/c1-4-11(2,3)10(13)12-14-9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyVNWVUVSNMXYUJE-UHFFFAOYSA-N
XLogP2.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-2,2-dimethylbutanamide?
The IUPAC name of N-cyclopentyloxy-2,2-dimethylbutanamide (CID 83205695) is N-cyclopentyloxy-2,2-dimethylbutanamide.
What is the SMILES notation for N-cyclopentyloxy-2,2-dimethylbutanamide?
The canonical SMILES for N-cyclopentyloxy-2,2-dimethylbutanamide is CCC(C)(C)C(=O)NOC1CCCC1.
What is the InChIKey of N-cyclopentyloxy-2,2-dimethylbutanamide?
The InChIKey is VNWVUVSNMXYUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-4-11(2,3)10(13)12-14-9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,12,13).
What are the key properties of N-cyclopentyloxy-2,2-dimethylbutanamide?
N-cyclopentyloxy-2,2-dimethylbutanamide has a molecular weight of 199.29 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-2,2-dimethylbutanamide is sourced from PubChem (CID 83205695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).