4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide

C19H23F3N4O — CID 23202763

IUPAC4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)C(CCn1ccnc1)N1CCCCC1
InChIInChI=1S/C19H23F3N4O/c20-19(21,22)15-4-6-16(7-5-15)24-18(27)17(26-10-2-1-3-11-26)8-12-25-13-9-23-14-25/h4-7,9,13-14,17H,1-3,8,10-12H2,(H,24,27)
InChIKeyUCVKYCXGUXLVLK-UHFFFAOYSA-N
MW380.41 g/mol
LogP3.79
Rot. Bonds6

About 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide

4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide (PubChem CID 23202763) has the molecular formula C19H23F3N4O and a molecular weight of 380.41 g/mol. Its IUPAC name is 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide.

Molecular Properties

Compound Name4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide
PubChem CID23202763
Molecular FormulaC19H23F3N4O
Molecular Weight380.41 g/mol
Exact Mass380.18
IUPAC Name4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)C(CCn1ccnc1)N1CCCCC1
InChIInChI=1S/C19H23F3N4O/c20-19(21,22)15-4-6-16(7-5-15)24-18(27)17(26-10-2-1-3-11-26)8-12-25-13-9-23-14-25/h4-7,9,13-14,17H,1-3,8,10-12H2,(H,24,27)
InChIKeyUCVKYCXGUXLVLK-UHFFFAOYSA-N
XLogP3.79
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide?
The IUPAC name of 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide (CID 23202763) is 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide.
What is the SMILES notation for 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide?
The canonical SMILES for 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide is O=C(Nc1ccc(C(F)(F)F)cc1)C(CCn1ccnc1)N1CCCCC1.
What is the InChIKey of 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide?
The InChIKey is UCVKYCXGUXLVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23F3N4O/c20-19(21,22)15-4-6-16(7-5-15)24-18(27)17(26-10-2-1-3-11-26)8-12-25-13-9-23-14-25/h4-7,9,13-14,17H,1-3,8,10-12H2,(H,24,27).
What are the key properties of 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide?
4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide has a molecular weight of 380.41 g/mol, XLogP of 3.79, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-2-piperidin-1-yl-N-[4-(trifluoromethyl)phenyl]butanamide is sourced from PubChem (CID 23202763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).