1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine

C13H18FN — CID 107004239

IUPAC1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccccc1F)C1CC1(C)C
InChIInChI=1S/C13H18FN/c1-13(2)8-10(13)12(15-3)9-6-4-5-7-11(9)14/h4-7,10,12,15H,8H2,1-3H3
InChIKeyCIZGAMXBUQACET-UHFFFAOYSA-N
MW207.29 g/mol
LogP3.13
Rot. Bonds3

About 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine

1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine (PubChem CID 107004239) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine
PubChem CID107004239
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccccc1F)C1CC1(C)C
InChIInChI=1S/C13H18FN/c1-13(2)8-10(13)12(15-3)9-6-4-5-7-11(9)14/h4-7,10,12,15H,8H2,1-3H3
InChIKeyCIZGAMXBUQACET-UHFFFAOYSA-N
XLogP3.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424379
4-[(2-fluorophenyl)-(methylamino)methyl]cyclohexan-1-one
CID 116957100
1-(4-tert-butylcyclohexyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65400352
1-(2,2-dimethylcyclopropyl)-1-isoquinolin-8-yl-N-methylmethanamine
CID 107005206
[(2,2-dimethylcyclohexyl)-(2-fluorophenyl)methyl]hydrazine
CID 107193522
4-[(2-fluorophenyl)-(methylamino)methyl]cyclohexane-1-carboxylic acid
CID 116953971
1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
CID 107004152
N-methyl-1-(2-methylsulfanylphenyl)-1-(2,2,5,5-tetramethyloxolan-3-yl)methanamine
CID 105053103
1-(2-fluorophenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63250536
[(2,2-dimethylcyclopropyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 107005656
[(2,2-dimethylcyclopropyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107005670
1-(3,4-dihydro-2H-chromen-3-yl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65411667

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine (CID 107004239) is 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine is CNC(c1ccccc1F)C1CC1(C)C.
What is the InChIKey of 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The InChIKey is CIZGAMXBUQACET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-13(2)8-10(13)12(15-3)9-6-4-5-7-11(9)14/h4-7,10,12,15H,8H2,1-3H3.
What are the key properties of 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine?
1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine has a molecular weight of 207.29 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 107004239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).