2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide

C10H16FNO — CID 91204560

IUPAC2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide
SMILESC=C1CCC(C(=O)N(C)C)C(F)C1
InChIInChI=1S/C10H16FNO/c1-7-4-5-8(9(11)6-7)10(13)12(2)3/h8-9H,1,4-6H2,2-3H3
InChIKeyFGSZUVBFQBHVPO-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.77
Rot. Bonds1

About 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide

2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide (PubChem CID 91204560) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide
PubChem CID91204560
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide
SMILESC=C1CCC(C(=O)N(C)C)C(F)C1
InChIInChI=1S/C10H16FNO/c1-7-4-5-8(9(11)6-7)10(13)12(2)3/h8-9H,1,4-6H2,2-3H3
InChIKeyFGSZUVBFQBHVPO-UHFFFAOYSA-N
XLogP1.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-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

(2-Fluoro-4-methylidenecyclohexyl)-pyrrolidin-1-ylmethanone
CID 91216241
2-fluoro-N-methyl-4-methylidenecyclohexane-1-carboxamide
CID 91497194
3-[(2-fluoro-2-methylcyclopropyl)methyl]-N,N-dipropylbut-3-enamide
CID 178053917
2-(cyclohexylmethyl)-N,N-dimethylprop-2-enamide
CID 134943112
(3S)-N,N-dimethyl-3-propyloct-7-enamide
CID 134962587
N-methoxy-N-methyl-2-[(1R)-2-methylidenecyclohexyl]acetamide
CID 135001013
N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide
CID 164669950
N,N-dimethyl-2-[(1S,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide
CID 164669951
N,N,6-trimethylhept-6-enamide
CID 18335945
(4-Methylidenecyclohexyl)-piperidin-1-ylmethanone
CID 90711558
(3-Methylidenecyclohexyl)-pyrrolidin-1-ylmethanone
CID 90771932
N,N-dimethyl-3-methylidenecyclohexane-1-carboxamide
CID 90820032

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide?
The IUPAC name of 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide (CID 91204560) is 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide.
What is the SMILES notation for 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide?
The canonical SMILES for 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide is C=C1CCC(C(=O)N(C)C)C(F)C1.
What is the InChIKey of 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide?
The InChIKey is FGSZUVBFQBHVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c1-7-4-5-8(9(11)6-7)10(13)12(2)3/h8-9H,1,4-6H2,2-3H3.
What are the key properties of 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide?
2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide has a molecular weight of 185.24 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N-dimethyl-4-methylidenecyclohexane-1-carboxamide is sourced from PubChem (CID 91204560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).