N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide

C18H25F3N2O2 — CID 119825481

IUPACN-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide
SMILESCCCN(C(=O)CCc1ccccc1OC(F)(F)F)C1CCNCC1
InChIInChI=1S/C18H25F3N2O2/c1-2-13-23(15-9-11-22-12-10-15)17(24)8-7-14-5-3-4-6-16(14)25-18(19,20)21/h3-6,15,22H,2,7-13H2,1H3
InChIKeyGUTAZXXZPXMWIA-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.51
Rot. Bonds7

About N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide

N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide (PubChem CID 119825481) has the molecular formula C18H25F3N2O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide.

Molecular Properties

Compound NameN-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide
PubChem CID119825481
Molecular FormulaC18H25F3N2O2
Molecular Weight358.40 g/mol
Exact Mass358.19
IUPAC NameN-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide
SMILESCCCN(C(=O)CCc1ccccc1OC(F)(F)F)C1CCNCC1
InChIInChI=1S/C18H25F3N2O2/c1-2-13-23(15-9-11-22-12-10-15)17(24)8-7-14-5-3-4-6-16(14)25-18(19,20)21/h3-6,15,22H,2,7-13H2,1H3
InChIKeyGUTAZXXZPXMWIA-UHFFFAOYSA-N
XLogP3.51
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-methylphenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 62367590
N-piperidin-4-yl-3-[2-(trifluoromethoxy)phenyl]propanamide
CID 119389217
N-piperidin-4-yl-2-(2-propan-2-yloxyphenyl)-N-propylacetamide
CID 119823731
3-(2-phenylphenoxy)-N-piperidin-4-yl-N-propylpropanamide
CID 119825238
2-(2-tert-butylphenoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119824866
N-piperidin-4-yl-N-propyl-2-(trifluoromethoxy)benzenesulfonamide;hydrochloride
CID 119994071
N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidin-3-amine
CID 63297774
3-(2,5-difluorophenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532213
2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119825135
3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825837
3-[methyl-[3-[2-(trifluoromethoxy)phenyl]propanoyl]amino]propanoic acid
CID 119233204
3-(2-methoxyphenoxy)-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119530663

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide?
The IUPAC name of N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide (CID 119825481) is N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide.
What is the SMILES notation for N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide?
The canonical SMILES for N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide is CCCN(C(=O)CCc1ccccc1OC(F)(F)F)C1CCNCC1.
What is the InChIKey of N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide?
The InChIKey is GUTAZXXZPXMWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25F3N2O2/c1-2-13-23(15-9-11-22-12-10-15)17(24)8-7-14-5-3-4-6-16(14)25-18(19,20)21/h3-6,15,22H,2,7-13H2,1H3.
What are the key properties of N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide?
N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide has a molecular weight of 358.40 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide is sourced from PubChem (CID 119825481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).