1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine

C9H18FN — CID 144866434

IUPAC1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine
SMILESC[C@@H]1CCC(F)(CN(C)C)C1
InChIInChI=1S/C9H18FN/c1-8-4-5-9(10,6-8)7-11(2)3/h8H,4-7H2,1-3H3/t8-,9?/m1/s1
InChIKeyCBOUHPRZLVEJEH-VEDVMXKPSA-N
MW159.25 g/mol
LogP2.08
Rot. Bonds2

About 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine

1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine (PubChem CID 144866434) has the molecular formula C9H18FN and a molecular weight of 159.25 g/mol. Its IUPAC name is 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine
PubChem CID144866434
Molecular FormulaC9H18FN
Molecular Weight159.25 g/mol
Exact Mass159.14
IUPAC Name1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine
SMILESC[C@@H]1CCC(F)(CN(C)C)C1
InChIInChI=1S/C9H18FN/c1-8-4-5-9(10,6-8)7-11(2)3/h8H,4-7H2,1-3H3/t8-,9?/m1/s1
InChIKeyCBOUHPRZLVEJEH-VEDVMXKPSA-N
XLogP2.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.25
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine (CID 144866434) is 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine is C[C@@H]1CCC(F)(CN(C)C)C1.
What is the InChIKey of 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine?
The InChIKey is CBOUHPRZLVEJEH-VEDVMXKPSA-N. The full InChI is InChI=1S/C9H18FN/c1-8-4-5-9(10,6-8)7-11(2)3/h8H,4-7H2,1-3H3/t8-,9?/m1/s1.
What are the key properties of 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine?
1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine has a molecular weight of 159.25 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-1-fluoro-3-methylcyclopentyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 144866434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).