N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine

C14H25F3N2 — CID 79860413

IUPACN,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine
SMILESCNC1C(N2CCC(C(F)(F)F)CC2)CCC1(C)C
InChIInChI=1S/C14H25F3N2/c1-13(2)7-4-11(12(13)18-3)19-8-5-10(6-9-19)14(15,16)17/h10-12,18H,4-9H2,1-3H3
InChIKeyNSWLGIGHVJLQOM-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.04
Rot. Bonds2

About N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine

N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine (PubChem CID 79860413) has the molecular formula C14H25F3N2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine
PubChem CID79860413
Molecular FormulaC14H25F3N2
Molecular Weight278.36 g/mol
Exact Mass278.20
IUPAC NameN,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine
SMILESCNC1C(N2CCC(C(F)(F)F)CC2)CCC1(C)C
InChIInChI=1S/C14H25F3N2/c1-13(2)7-4-11(12(13)18-3)19-8-5-10(6-9-19)14(15,16)17/h10-12,18H,4-9H2,1-3H3
InChIKeyNSWLGIGHVJLQOM-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine?
The IUPAC name of N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine (CID 79860413) is N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine?
The canonical SMILES for N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine is CNC1C(N2CCC(C(F)(F)F)CC2)CCC1(C)C.
What is the InChIKey of N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine?
The InChIKey is NSWLGIGHVJLQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2/c1-13(2)7-4-11(12(13)18-3)19-8-5-10(6-9-19)14(15,16)17/h10-12,18H,4-9H2,1-3H3.
What are the key properties of N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine?
N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine has a molecular weight of 278.36 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]cyclopentan-1-amine is sourced from PubChem (CID 79860413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).