N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

C14H25F3N2 — CID 64907979

IUPACN-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC1CCC(NC2CCN(CC(F)(F)F)CC2)C1C
InChIInChI=1S/C14H25F3N2/c1-10-3-4-13(11(10)2)18-12-5-7-19(8-6-12)9-14(15,16)17/h10-13,18H,3-9H2,1-2H3
InChIKeyZJISMFVMPHANGC-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.04
Rot. Bonds3

About N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (PubChem CID 64907979) has the molecular formula C14H25F3N2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
PubChem CID64907979
Molecular FormulaC14H25F3N2
Molecular Weight278.36 g/mol
Exact Mass278.20
IUPAC NameN-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC1CCC(NC2CCN(CC(F)(F)F)CC2)C1C
InChIInChI=1S/C14H25F3N2/c1-10-3-4-13(11(10)2)18-12-5-7-19(8-6-12)9-14(15,16)17/h10-13,18H,3-9H2,1-2H3
InChIKeyZJISMFVMPHANGC-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The IUPAC name of N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (CID 64907979) is N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is CC1CCC(NC2CCN(CC(F)(F)F)CC2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The InChIKey is ZJISMFVMPHANGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2/c1-10-3-4-13(11(10)2)18-12-5-7-19(8-6-12)9-14(15,16)17/h10-13,18H,3-9H2,1-2H3.
What are the key properties of N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is sourced from PubChem (CID 64907979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).