N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide

C15H19F3N2O — CID 60895336

IUPACN-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
SMILESO=C(NCCC1CCCNC1)c1ccccc1C(F)(F)F
InChIInChI=1S/C15H19F3N2O/c16-15(17,18)13-6-2-1-5-12(13)14(21)20-9-7-11-4-3-8-19-10-11/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21)
InChIKeyDGVGZFVROXYZQP-UHFFFAOYSA-N
MW300.32 g/mol
LogP2.82
Rot. Bonds4

About N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide

N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide (PubChem CID 60895336) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
PubChem CID60895336
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC NameN-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
SMILESO=C(NCCC1CCCNC1)c1ccccc1C(F)(F)F
InChIInChI=1S/C15H19F3N2O/c16-15(17,18)13-6-2-1-5-12(13)14(21)20-9-7-11-4-3-8-19-10-11/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21)
InChIKeyDGVGZFVROXYZQP-UHFFFAOYSA-N
XLogP2.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554934
2-(2-phenylethyl)-N-(2-piperidin-3-ylethyl)benzamide
CID 119557940
2,3,4-trifluoro-N-(2-piperidin-3-ylethyl)benzamide
CID 79749359
N-(2-piperidin-3-ylethyl)-2-prop-2-enoxybenzamide;hydrochloride
CID 119559291
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
N-(2-cyclopropylethyl)-2-fluoro-3-(trifluoromethyl)benzamide
CID 79885002
2-chloro-6-fluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119559044
N-(2-piperidin-3-ylethyl)-4-(trifluoromethylsulfanyl)benzamide
CID 119557493
4-fluoro-2-iodo-N-(2-piperidin-3-ylethyl)benzamide
CID 103806776
N-(2-piperidin-3-ylethyl)-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119558465
N-[[(2R)-pyrrolidin-2-yl]methyl]-2-(trifluoromethyl)benzamide;hydrochloride
CID 175666321
1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea
CID 60895338

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide (CID 60895336) is N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide is O=C(NCCC1CCCNC1)c1ccccc1C(F)(F)F.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide?
The InChIKey is DGVGZFVROXYZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O/c16-15(17,18)13-6-2-1-5-12(13)14(21)20-9-7-11-4-3-8-19-10-11/h1-2,5-6,11,19H,3-4,7-10H2,(H,20,21).
What are the key properties of N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide?
N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide has a molecular weight of 300.32 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 60895336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).