N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide

C15H24F3N3O2 — CID 17443271

IUPACN-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide
SMILESCC(C(=O)NC(=O)NC1CCCC1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C15H24F3N3O2/c1-10(21-8-4-5-11(9-21)15(16,17)18)13(22)20-14(23)19-12-6-2-3-7-12/h10-12H,2-9H2,1H3,(H2,19,20,22,23)
InChIKeyAFSNTJLMGJKGBR-UHFFFAOYSA-N
MW335.37 g/mol
LogP2.42
Rot. Bonds3

About N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide

N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide (PubChem CID 17443271) has the molecular formula C15H24F3N3O2 and a molecular weight of 335.37 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide
PubChem CID17443271
Molecular FormulaC15H24F3N3O2
Molecular Weight335.37 g/mol
Exact Mass335.18
IUPAC NameN-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide
SMILESCC(C(=O)NC(=O)NC1CCCC1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C15H24F3N3O2/c1-10(21-8-4-5-11(9-21)15(16,17)18)13(22)20-14(23)19-12-6-2-3-7-12/h10-12H,2-9H2,1H3,(H2,19,20,22,23)
InChIKeyAFSNTJLMGJKGBR-UHFFFAOYSA-N
XLogP2.42
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide (CID 17443271) is N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide is CC(C(=O)NC(=O)NC1CCCC1)N1CCCC(C(F)(F)F)C1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide?
The InChIKey is AFSNTJLMGJKGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F3N3O2/c1-10(21-8-4-5-11(9-21)15(16,17)18)13(22)20-14(23)19-12-6-2-3-7-12/h10-12H,2-9H2,1H3,(H2,19,20,22,23).
What are the key properties of N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide?
N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide has a molecular weight of 335.37 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide is sourced from PubChem (CID 17443271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).