N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide

C10H18FNO — CID 130735439

IUPACN-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide
SMILESCC(C)(C)CNC(=O)C1(F)CCC1
InChIInChI=1S/C10H18FNO/c1-9(2,3)7-12-8(13)10(11)5-4-6-10/h4-7H2,1-3H3,(H,12,13)
InChIKeyGIDOMFHLLFACNT-UHFFFAOYSA-N
MW187.26 g/mol
LogP2.04
Rot. Bonds2

About N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide

N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide (PubChem CID 130735439) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide
PubChem CID130735439
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC NameN-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide
SMILESCC(C)(C)CNC(=O)C1(F)CCC1
InChIInChI=1S/C10H18FNO/c1-9(2,3)7-12-8(13)10(11)5-4-6-10/h4-7H2,1-3H3,(H,12,13)
InChIKeyGIDOMFHLLFACNT-UHFFFAOYSA-N
XLogP2.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-dimethylpropyl)-1-hydroxycyclobutane-1-carboxamide
CID 126988304
1-bromo-N-(2,2-dimethylpropyl)cyclobutane-1-carboxamide
CID 130778437
1-fluoro-N-methylcyclobutane-1-carboxamide
CID 130266037
1-carbamothioyl-N-(2,2-dimethylpropyl)cyclobutane-1-carboxamide
CID 80590145
N-(2,2-dimethylpropyl)bicyclo[1.1.0]butane-1-carboxamide
CID 176757917
1-cyano-N-(2,2-dimethylpropyl)cyclopropane-1-carboxamide
CID 59860392
N-ethyl-1-fluorocyclopropane-1-carboxamide;molecular hydrogen
CID 176683431
N-butan-2-yl-1-fluorocyclobutane-1-carboxamide
CID 130944336
N-(2,2-dimethylpropyl)-1-phenylcyclohexane-1-carboxamide
CID 110474016
N-(1-cyclopropyl-3,3-dimethylbutan-2-yl)-1-fluorocyclobutane-1-carboxamide
CID 171608667
1-(aminomethyl)-N-(2,2-dimethylpropyl)-4-methylcyclohexane-1-carboxamide
CID 113310485
(3S)-3-fluoro-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 129321060

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide (CID 130735439) is N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide is CC(C)(C)CNC(=O)C1(F)CCC1.
What is the InChIKey of N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide?
The InChIKey is GIDOMFHLLFACNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-9(2,3)7-12-8(13)10(11)5-4-6-10/h4-7H2,1-3H3,(H,12,13).
What are the key properties of N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide?
N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide has a molecular weight of 187.26 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-1-fluorocyclobutane-1-carboxamide is sourced from PubChem (CID 130735439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).