N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide

C10H17F3N2O — CID 43089163

IUPACN-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide
SMILESCC(NCC(F)(F)F)C(=O)NC1CCCC1
InChIInChI=1S/C10H17F3N2O/c1-7(14-6-10(11,12)13)9(16)15-8-4-2-3-5-8/h7-8,14H,2-6H2,1H3,(H,15,16)
InChIKeyWJLKCDVLOVCJDP-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.59
Rot. Bonds4

About N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide

N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide (PubChem CID 43089163) has the molecular formula C10H17F3N2O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide
PubChem CID43089163
Molecular FormulaC10H17F3N2O
Molecular Weight238.25 g/mol
Exact Mass238.13
IUPAC NameN-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide
SMILESCC(NCC(F)(F)F)C(=O)NC1CCCC1
InChIInChI=1S/C10H17F3N2O/c1-7(14-6-10(11,12)13)9(16)15-8-4-2-3-5-8/h7-8,14H,2-6H2,1H3,(H,15,16)
InChIKeyWJLKCDVLOVCJDP-UHFFFAOYSA-N
XLogP1.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide?
The IUPAC name of N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide (CID 43089163) is N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide.
What is the SMILES notation for N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide?
The canonical SMILES for N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide is CC(NCC(F)(F)F)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide?
The InChIKey is WJLKCDVLOVCJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O/c1-7(14-6-10(11,12)13)9(16)15-8-4-2-3-5-8/h7-8,14H,2-6H2,1H3,(H,15,16).
What are the key properties of N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide?
N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide has a molecular weight of 238.25 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2,2,2-trifluoroethylamino)propanamide is sourced from PubChem (CID 43089163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).