2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide

C7H12FNO — CID 77445855

IUPAC2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide
SMILESCC(C)NC(=O)C1CC1F
InChIInChI=1S/C7H12FNO/c1-4(2)9-7(10)5-3-6(5)8/h4-6H,3H2,1-2H3,(H,9,10)
InChIKeyLSTMJXMMHIJRAW-UHFFFAOYSA-N
MW145.18 g/mol
LogP0.87
Rot. Bonds2

About 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide

2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide (PubChem CID 77445855) has the molecular formula C7H12FNO and a molecular weight of 145.18 g/mol. Its IUPAC name is 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide
PubChem CID77445855
Molecular FormulaC7H12FNO
Molecular Weight145.18 g/mol
Exact Mass145.09
IUPAC Name2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide
SMILESCC(C)NC(=O)C1CC1F
InChIInChI=1S/C7H12FNO/c1-4(2)9-7(10)5-3-6(5)8/h4-6H,3H2,1-2H3,(H,9,10)
InChIKeyLSTMJXMMHIJRAW-UHFFFAOYSA-N
XLogP0.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide (CID 77445855) is 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide is CC(C)NC(=O)C1CC1F.
What is the InChIKey of 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide?
The InChIKey is LSTMJXMMHIJRAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FNO/c1-4(2)9-7(10)5-3-6(5)8/h4-6H,3H2,1-2H3,(H,9,10).
What are the key properties of 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide?
2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide has a molecular weight of 145.18 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-propan-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 77445855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).