3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide

C8H14FNO2 — CID 126989045

IUPAC3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide
SMILESCON(C)C(=O)C1CCC(F)C1
InChIInChI=1S/C8H14FNO2/c1-10(12-2)8(11)6-3-4-7(9)5-6/h6-7H,3-5H2,1-2H3
InChIKeyXCMHRXFBMFGDNZ-UHFFFAOYSA-N
MW175.20 g/mol
LogP1.14
Rot. Bonds2

About 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide

3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide (PubChem CID 126989045) has the molecular formula C8H14FNO2 and a molecular weight of 175.20 g/mol. Its IUPAC name is 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide
PubChem CID126989045
Molecular FormulaC8H14FNO2
Molecular Weight175.20 g/mol
Exact Mass175.10
IUPAC Name3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide
SMILESCON(C)C(=O)C1CCC(F)C1
InChIInChI=1S/C8H14FNO2/c1-10(12-2)8(11)6-3-4-7(9)5-6/h6-7H,3-5H2,1-2H3
InChIKeyXCMHRXFBMFGDNZ-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'}

Analyze 3-fluoro-N-methoxy-N-methylcyclopentane-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

Related Compounds

CID 11147854
CID 11147854
CID 134861230
CID 134861230
CID 135016110
CID 135016110
CID 117915933
CID 117915933
CID 53403834
CID 53403834
CID 87334074
CID 87334074
CID 118342885
CID 118342885
CID 129050682
CID 129050682
CID 137408250
CID 137408250
CID 137412438
CID 137412438
CID 137412512
CID 137412512
CID 140191462
CID 140191462

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide (CID 126989045) is 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide is CON(C)C(=O)C1CCC(F)C1.
What is the InChIKey of 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide?
The InChIKey is XCMHRXFBMFGDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO2/c1-10(12-2)8(11)6-3-4-7(9)5-6/h6-7H,3-5H2,1-2H3.
What are the key properties of 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide?
3-fluoro-N-methoxy-N-methylcyclopentane-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 3-fluoro-N-methoxy-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 126989045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).