N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine

C8H14F3N — CID 121208298

IUPACN-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine
SMILESCNCC1(C(F)(F)F)CCCC1
InChIInChI=1S/C8H14F3N/c1-12-6-7(8(9,10)11)4-2-3-5-7/h12H,2-6H2,1H3
InChIKeyWRAOCGJFSNRXJC-UHFFFAOYSA-N
MW181.20 g/mol
LogP2.33
Rot. Bonds2

About N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine

N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine (PubChem CID 121208298) has the molecular formula C8H14F3N and a molecular weight of 181.20 g/mol. Its IUPAC name is N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine
PubChem CID121208298
Molecular FormulaC8H14F3N
Molecular Weight181.20 g/mol
Exact Mass181.11
IUPAC NameN-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine
SMILESCNCC1(C(F)(F)F)CCCC1
InChIInChI=1S/C8H14F3N/c1-12-6-7(8(9,10)11)4-2-3-5-7/h12H,2-6H2,1H3
InChIKeyWRAOCGJFSNRXJC-UHFFFAOYSA-N
XLogP2.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine?
The IUPAC name of N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine (CID 121208298) is N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine?
The canonical SMILES for N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine is CNCC1(C(F)(F)F)CCCC1.
What is the InChIKey of N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine?
The InChIKey is WRAOCGJFSNRXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3N/c1-12-6-7(8(9,10)11)4-2-3-5-7/h12H,2-6H2,1H3.
What are the key properties of N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine?
N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine has a molecular weight of 181.20 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(trifluoromethyl)cyclopentyl]methanamine is sourced from PubChem (CID 121208298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).