1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide

C8H14FNO2 — CID 156530580

IUPAC1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide
SMILESCON(C)C(=O)C1(F)CCC1C
InChIInChI=1S/C8H14FNO2/c1-6-4-5-8(6,9)7(11)10(2)12-3/h6H,4-5H2,1-3H3
InChIKeyCNASYHYVEVXQDG-UHFFFAOYSA-N
MW175.20 g/mol
LogP1.14
Rot. Bonds2

About 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide

1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide (PubChem CID 156530580) has the molecular formula C8H14FNO2 and a molecular weight of 175.20 g/mol. Its IUPAC name is 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide
PubChem CID156530580
Molecular FormulaC8H14FNO2
Molecular Weight175.20 g/mol
Exact Mass175.10
IUPAC Name1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide
SMILESCON(C)C(=O)C1(F)CCC1C
InChIInChI=1S/C8H14FNO2/c1-6-4-5-8(6,9)7(11)10(2)12-3/h6H,4-5H2,1-3H3
InChIKeyCNASYHYVEVXQDG-UHFFFAOYSA-N
XLogP1.14
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.20
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methoxy-N-methylcyclobutanecarboxamide
CID 45084194
3,3-Difluoro-n-methoxy-n-methylcyclobutanecarboxamide
CID 87068234
1-fluoro-N-methoxy-N-methylcyclopentanecarboxamide
CID 118342885
(2S)-3-(3,3-difluorocyclobutyl)-N-methoxy-N,2-dimethylpropanamide
CID 122545592
3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide
CID 126989045
5,5,5-trifluoro-N-methoxy-N,3-dimethylpentanamide
CID 129050682
1-fluoro-N-methoxy-N-methyl-cyclobutanecarboxamide
CID 130246938
2,2-difluoro-N-methoxy-N-methylspiro[2.3]hexane-5-carboxamide
CID 137408256
2-(3,3-difluorocyclobutyl)-N-methoxy-N-methylacetamide
CID 140191462
N-Methoxy-N-methyl-3-(trifluoromethyl)cyclobutane-1-carboxamide
CID 156495434
N-methoxy-N-methyl-3-(2,2,2-trifluoroethyl)cyclobutane-1-carboxamide
CID 168175023
(2S,4R)-4-fluoro-N-methoxy-N,2-dimethylhexanamide
CID 168948667

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide (CID 156530580) is 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide is CON(C)C(=O)C1(F)CCC1C.
What is the InChIKey of 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide?
The InChIKey is CNASYHYVEVXQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO2/c1-6-4-5-8(6,9)7(11)10(2)12-3/h6H,4-5H2,1-3H3.
What are the key properties of 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide?
1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide has a molecular weight of 175.20 g/mol, XLogP of 1.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 156530580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).