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

C12H19F3N2O — CID 106213249

IUPAC3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide
SMILESO=C(CCC1CCCCN1)NC1(C(F)(F)F)CC1
InChIInChI=1S/C12H19F3N2O/c13-12(14,15)11(6-7-11)17-10(18)5-4-9-3-1-2-8-16-9/h9,16H,1-8H2,(H,17,18)
InChIKeyPAONLPRUWRPDCE-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.12
Rot. Bonds4

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

3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide (PubChem CID 106213249) has the molecular formula C12H19F3N2O and a molecular weight of 264.29 g/mol. Its IUPAC name is 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide.

Molecular Properties

Compound Name3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide
PubChem CID106213249
Molecular FormulaC12H19F3N2O
Molecular Weight264.29 g/mol
Exact Mass264.14
IUPAC Name3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide
SMILESO=C(CCC1CCCCN1)NC1(C(F)(F)F)CC1
InChIInChI=1S/C12H19F3N2O/c13-12(14,15)11(6-7-11)17-10(18)5-4-9-3-1-2-8-16-9/h9,16H,1-8H2,(H,17,18)
InChIKeyPAONLPRUWRPDCE-UHFFFAOYSA-N
XLogP2.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-[(2S)-piperidin-2-yl]propanamide
CID 94374343
N-(2-pyrrolidin-2-ylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106219127
N-(1-piperidin-2-ylpropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158626
N-(2-hydroxycyclohexyl)-3-piperidin-2-ylpropanamide
CID 55064327
N-(2-cyclohexylethyl)-3-piperidin-2-ylpropanamide
CID 62210016
N-(4-hydroxycyclohexyl)-3-piperidin-2-ylpropanamide
CID 62212049
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-3-piperidin-2-ylpropanamide
CID 114010587
N-tert-butyl-3-[(2R)-pyrrolidin-2-yl]propanamide
CID 154936756
3-(azepan-2-yl)propanoic acid
CID 69475849
N-[(2S)-1-hydroxypropan-2-yl]-3-piperidin-2-ylpropanamide
CID 107218985
N-[(2R)-1-hydroxypropan-2-yl]-3-piperidin-2-ylpropanamide
CID 107218481
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide
CID 83110283

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide?
The IUPAC name of 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide (CID 106213249) is 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide.
What is the SMILES notation for 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide?
The canonical SMILES for 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide is O=C(CCC1CCCCN1)NC1(C(F)(F)F)CC1.
What is the InChIKey of 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide?
The InChIKey is PAONLPRUWRPDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N2O/c13-12(14,15)11(6-7-11)17-10(18)5-4-9-3-1-2-8-16-9/h9,16H,1-8H2,(H,17,18).
What are the key properties of 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide?
3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide has a molecular weight of 264.29 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-2-yl-N-[1-(trifluoromethyl)cyclopropyl]propanamide is sourced from PubChem (CID 106213249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).