N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide

C11H20FNO — CID 134489872

IUPACN-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NC1CC(C)(F)C1
InChIInChI=1S/C11H20FNO/c1-10(2,3)7-9(14)13-8-5-11(4,12)6-8/h8H,5-7H2,1-4H3,(H,13,14)
InChIKeyOAXIXDDNKCBTJE-UHFFFAOYSA-N
MW201.28 g/mol
LogP2.43
Rot. Bonds2

About N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide

N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide (PubChem CID 134489872) has the molecular formula C11H20FNO and a molecular weight of 201.28 g/mol. Its IUPAC name is N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide
PubChem CID134489872
Molecular FormulaC11H20FNO
Molecular Weight201.28 g/mol
Exact Mass201.15
IUPAC NameN-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NC1CC(C)(F)C1
InChIInChI=1S/C11H20FNO/c1-10(2,3)7-9(14)13-8-5-11(4,12)6-8/h8H,5-7H2,1-4H3,(H,13,14)
InChIKeyOAXIXDDNKCBTJE-UHFFFAOYSA-N
XLogP2.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.28
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide?
The IUPAC name of N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide (CID 134489872) is N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide.
What is the SMILES notation for N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide?
The canonical SMILES for N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide is CC(C)(C)CC(=O)NC1CC(C)(F)C1.
What is the InChIKey of N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide?
The InChIKey is OAXIXDDNKCBTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FNO/c1-10(2,3)7-9(14)13-8-5-11(4,12)6-8/h8H,5-7H2,1-4H3,(H,13,14).
What are the key properties of N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide?
N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide has a molecular weight of 201.28 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-3-methylcyclobutyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 134489872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).