N-propyl-1-(trifluoromethyl)cyclopentan-1-amine

C9H16F3N — CID 66206814

IUPACN-propyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCCCNC1(C(F)(F)F)CCCC1
InChIInChI=1S/C9H16F3N/c1-2-7-13-8(9(10,11)12)5-3-4-6-8/h13H,2-7H2,1H3
InChIKeyQODIGUSNUKAQTM-UHFFFAOYSA-N
MW195.23 g/mol
LogP2.86
Rot. Bonds3

About N-propyl-1-(trifluoromethyl)cyclopentan-1-amine

N-propyl-1-(trifluoromethyl)cyclopentan-1-amine (PubChem CID 66206814) has the molecular formula C9H16F3N and a molecular weight of 195.23 g/mol. Its IUPAC name is N-propyl-1-(trifluoromethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-propyl-1-(trifluoromethyl)cyclopentan-1-amine
PubChem CID66206814
Molecular FormulaC9H16F3N
Molecular Weight195.23 g/mol
Exact Mass195.12
IUPAC NameN-propyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCCCNC1(C(F)(F)F)CCCC1
InChIInChI=1S/C9H16F3N/c1-2-7-13-8(9(10,11)12)5-3-4-6-8/h13H,2-7H2,1H3
InChIKeyQODIGUSNUKAQTM-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(trifluoromethyl)cyclopentan-1-amine?
The IUPAC name of N-propyl-1-(trifluoromethyl)cyclopentan-1-amine (CID 66206814) is N-propyl-1-(trifluoromethyl)cyclopentan-1-amine.
What is the SMILES notation for N-propyl-1-(trifluoromethyl)cyclopentan-1-amine?
The canonical SMILES for N-propyl-1-(trifluoromethyl)cyclopentan-1-amine is CCCNC1(C(F)(F)F)CCCC1.
What is the InChIKey of N-propyl-1-(trifluoromethyl)cyclopentan-1-amine?
The InChIKey is QODIGUSNUKAQTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3N/c1-2-7-13-8(9(10,11)12)5-3-4-6-8/h13H,2-7H2,1H3.
What are the key properties of N-propyl-1-(trifluoromethyl)cyclopentan-1-amine?
N-propyl-1-(trifluoromethyl)cyclopentan-1-amine has a molecular weight of 195.23 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(trifluoromethyl)cyclopentan-1-amine is sourced from PubChem (CID 66206814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).