3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

C15H19F3N2O2 — CID 111912607

IUPAC3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESO=C(CCN1CCCC(O)C1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H19F3N2O2/c16-15(17,18)11-3-1-4-12(9-11)19-14(22)6-8-20-7-2-5-13(21)10-20/h1,3-4,9,13,21H,2,5-8,10H2,(H,19,22)
InChIKeyGJFRIICLHYKCGB-UHFFFAOYSA-N
MW316.32 g/mol
LogP2.49
Rot. Bonds4

About 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 111912607) has the molecular formula C15H19F3N2O2 and a molecular weight of 316.32 g/mol. Its IUPAC name is 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
PubChem CID111912607
Molecular FormulaC15H19F3N2O2
Molecular Weight316.32 g/mol
Exact Mass316.14
IUPAC Name3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESO=C(CCN1CCCC(O)C1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H19F3N2O2/c16-15(17,18)11-3-1-4-12(9-11)19-14(22)6-8-20-7-2-5-13(21)10-20/h1,3-4,9,13,21H,2,5-8,10H2,(H,19,22)
InChIKeyGJFRIICLHYKCGB-UHFFFAOYSA-N
XLogP2.49
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 111912608
2-(4-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 31480654
2-[3-(methylamino)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119920212
3-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 120774509
1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-ol
CID 5180021
N,N'-bis[3-(trifluoromethyl)phenyl]hexanediamide
CID 5058568
3-(3-methylpiperidin-1-yl)-3-oxo-N-[3-(trifluoromethyl)phenyl]propanamide
CID 108952355
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129367068
N-(3-methylphenyl)-3-[(3R)-3-methylpiperidin-1-yl]propanamide
CID 739962
2-[4-(difluoromethyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 166601910
3-(3-hydroxypiperidin-1-yl)-N-(4-morpholin-4-ylphenyl)propanamide
CID 71900221
3-[3-oxo-3-[3-(trifluoromethyl)anilino]propyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 3619896

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (CID 111912607) is 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is O=C(CCN1CCCC(O)C1)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is GJFRIICLHYKCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O2/c16-15(17,18)11-3-1-4-12(9-11)19-14(22)6-8-20-7-2-5-13(21)10-20/h1,3-4,9,13,21H,2,5-8,10H2,(H,19,22).
What are the key properties of 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 316.32 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxypiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 111912607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).