2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride

C15H20ClF3N2O — CID 120705635

IUPAC2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride
SMILESCNCC(=O)NC1CCCC1c1ccccc1C(F)(F)F.Cl
InChIInChI=1S/C15H19F3N2O.ClH/c1-19-9-14(21)20-13-8-4-6-11(13)10-5-2-3-7-12(10)15(16,17)18;/h2-3,5,7,11,13,19H,4,6,8-9H2,1H3,(H,20,21);1H
InChIKeyRFEAMKPWPUHDKL-UHFFFAOYSA-N
MW336.79 g/mol
LogP3.10
Rot. Bonds4

About 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride

2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride (PubChem CID 120705635) has the molecular formula C15H20ClF3N2O and a molecular weight of 336.79 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride
PubChem CID120705635
Molecular FormulaC15H20ClF3N2O
Molecular Weight336.79 g/mol
Exact Mass336.12
IUPAC Name2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride
SMILESCNCC(=O)NC1CCCC1c1ccccc1C(F)(F)F.Cl
InChIInChI=1S/C15H19F3N2O.ClH/c1-19-9-14(21)20-13-8-4-6-11(13)10-5-2-3-7-12(10)15(16,17)18;/h2-3,5,7,11,13,19H,4,6,8-9H2,1H3,(H,20,21);1H
InChIKeyRFEAMKPWPUHDKL-UHFFFAOYSA-N
XLogP3.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.79
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride?
The IUPAC name of 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride (CID 120705635) is 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride?
The canonical SMILES for 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride is CNCC(=O)NC1CCCC1c1ccccc1C(F)(F)F.Cl.
What is the InChIKey of 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride?
The InChIKey is RFEAMKPWPUHDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O.ClH/c1-19-9-14(21)20-13-8-4-6-11(13)10-5-2-3-7-12(10)15(16,17)18;/h2-3,5,7,11,13,19H,4,6,8-9H2,1H3,(H,20,21);1H.
What are the key properties of 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride?
2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride has a molecular weight of 336.79 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-[2-(trifluoromethyl)phenyl]cyclopentyl]acetamide;hydrochloride is sourced from PubChem (CID 120705635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).