N-[(1-fluorocyclobutyl)methyl]acetamide

C7H12FNO — CID 126992940

IUPACN-[(1-fluorocyclobutyl)methyl]acetamide
SMILESCC(=O)NCC1(F)CCC1
InChIInChI=1S/C7H12FNO/c1-6(10)9-5-7(8)3-2-4-7/h2-5H2,1H3,(H,9,10)
InChIKeyXNMCABYFUHCGEF-UHFFFAOYSA-N
MW145.18 g/mol
LogP1.01
Rot. Bonds2

About N-[(1-fluorocyclobutyl)methyl]acetamide

N-[(1-fluorocyclobutyl)methyl]acetamide (PubChem CID 126992940) has the molecular formula C7H12FNO and a molecular weight of 145.18 g/mol. Its IUPAC name is N-[(1-fluorocyclobutyl)methyl]acetamide.

Molecular Properties

Compound NameN-[(1-fluorocyclobutyl)methyl]acetamide
PubChem CID126992940
Molecular FormulaC7H12FNO
Molecular Weight145.18 g/mol
Exact Mass145.09
IUPAC NameN-[(1-fluorocyclobutyl)methyl]acetamide
SMILESCC(=O)NCC1(F)CCC1
InChIInChI=1S/C7H12FNO/c1-6(10)9-5-7(8)3-2-4-7/h2-5H2,1H3,(H,9,10)
InChIKeyXNMCABYFUHCGEF-UHFFFAOYSA-N
XLogP1.01
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 ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1-fluorocyclobutyl)methyl]acetamide?
The IUPAC name of N-[(1-fluorocyclobutyl)methyl]acetamide (CID 126992940) is N-[(1-fluorocyclobutyl)methyl]acetamide.
What is the SMILES notation for N-[(1-fluorocyclobutyl)methyl]acetamide?
The canonical SMILES for N-[(1-fluorocyclobutyl)methyl]acetamide is CC(=O)NCC1(F)CCC1.
What is the InChIKey of N-[(1-fluorocyclobutyl)methyl]acetamide?
The InChIKey is XNMCABYFUHCGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FNO/c1-6(10)9-5-7(8)3-2-4-7/h2-5H2,1H3,(H,9,10).
What are the key properties of N-[(1-fluorocyclobutyl)methyl]acetamide?
N-[(1-fluorocyclobutyl)methyl]acetamide has a molecular weight of 145.18 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-fluorocyclobutyl)methyl]acetamide is sourced from PubChem (CID 126992940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).