N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide

C19H20F3N3O — CID 119389365

IUPACN-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide
SMILESO=C(NC1CCNCC1)c1ccccc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H20F3N3O/c20-19(21,22)13-4-3-5-15(12-13)24-17-7-2-1-6-16(17)18(26)25-14-8-10-23-11-9-14/h1-7,12,14,23-24H,8-11H2,(H,25,26)
InChIKeyYMPWXAGQRHZIBS-UHFFFAOYSA-N
MW363.38 g/mol
LogP3.93
Rot. Bonds4

About N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide

N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide (PubChem CID 119389365) has the molecular formula C19H20F3N3O and a molecular weight of 363.38 g/mol. Its IUPAC name is N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide.

Molecular Properties

Compound NameN-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide
PubChem CID119389365
Molecular FormulaC19H20F3N3O
Molecular Weight363.38 g/mol
Exact Mass363.16
IUPAC NameN-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide
SMILESO=C(NC1CCNCC1)c1ccccc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H20F3N3O/c20-19(21,22)13-4-3-5-15(12-13)24-17-7-2-1-6-16(17)18(26)25-14-8-10-23-11-9-14/h1-7,12,14,23-24H,8-11H2,(H,25,26)
InChIKeyYMPWXAGQRHZIBS-UHFFFAOYSA-N
XLogP3.93
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 53.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyrrolidin-3-yl-2-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 119450033
N-[2-(cyclopropanecarbonylamino)ethyl]-2-[3-(trifluoromethyl)anilino]benzamide
CID 112767635
N-cyclopropyl-2-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 25353415
N-[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]piperidine-4-carboxamide;hydrochloride
CID 119305471
2-(3-methoxyanilino)-N-pyrrolidin-3-ylbenzamide
CID 119449915
N-cyclopropyl-6-[3-(trifluoromethyl)anilino]pyridazine-3-carboxamide
CID 109110127
N-(oxetan-3-ylmethyl)-2-[3-(trifluoromethyl)anilino]benzamide
CID 166247033
2-(4-methoxyanilino)-N-piperidin-4-ylbenzamide
CID 119386646
ethane;2-[3-(trifluoromethyl)anilino]benzamide
CID 142468111
2-(1H-indazol-5-ylamino)-N-piperidin-4-ylbenzamide
CID 22933442
N-cyclopentyl-6-[3-(trifluoromethyl)anilino]pyridazine-3-carboxamide
CID 109112395
N-[3-(2,5-dioxopyrrolidin-1-yl)propyl]-2-[3-(trifluoromethyl)anilino]benzamide
CID 56558972

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide?
The IUPAC name of N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide (CID 119389365) is N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide.
What is the SMILES notation for N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide?
The canonical SMILES for N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide is O=C(NC1CCNCC1)c1ccccc1Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide?
The InChIKey is YMPWXAGQRHZIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3N3O/c20-19(21,22)13-4-3-5-15(12-13)24-17-7-2-1-6-16(17)18(26)25-14-8-10-23-11-9-14/h1-7,12,14,23-24H,8-11H2,(H,25,26).
What are the key properties of N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide?
N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide has a molecular weight of 363.38 g/mol, XLogP of 3.93, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-2-[3-(trifluoromethyl)anilino]benzamide is sourced from PubChem (CID 119389365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).