N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C8H14FNO — CID 87668860

IUPACN-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NF)C1(C)C
InChIInChI=1S/C8H14FNO/c1-7(2)5(6(11)10-9)8(7,3)4/h5H,1-4H3,(H,10,11)
InChIKeyMBJPBFJYOFUJTG-UHFFFAOYSA-N
MW159.20 g/mol
LogP1.67
Rot. Bonds1

About N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 87668860) has the molecular formula C8H14FNO and a molecular weight of 159.20 g/mol. Its IUPAC name is N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID87668860
Molecular FormulaC8H14FNO
Molecular Weight159.20 g/mol
Exact Mass159.11
IUPAC NameN-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NF)C1(C)C
InChIInChI=1S/C8H14FNO/c1-7(2)5(6(11)10-9)8(7,3)4/h5H,1-4H3,(H,10,11)
InChIKeyMBJPBFJYOFUJTG-UHFFFAOYSA-N
XLogP1.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.20
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 87668860) is N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)NF)C1(C)C.
What is the InChIKey of N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is MBJPBFJYOFUJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO/c1-7(2)5(6(11)10-9)8(7,3)4/h5H,1-4H3,(H,10,11).
What are the key properties of N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 159.20 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 87668860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).