4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide

C15H23F3N2O2 — CID 138025333

IUPAC4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide
SMILESO=C(NC(C1CC1)C(F)(F)F)N1CCC(O)(C2CCC2)CC1
InChIInChI=1S/C15H23F3N2O2/c16-15(17,18)12(10-4-5-10)19-13(21)20-8-6-14(22,7-9-20)11-2-1-3-11/h10-12,22H,1-9H2,(H,19,21)
InChIKeyRLFOIDJPXHUTCR-UHFFFAOYSA-N
MW320.36 g/mol
LogP2.66
Rot. Bonds3

About 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide

4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide (PubChem CID 138025333) has the molecular formula C15H23F3N2O2 and a molecular weight of 320.36 g/mol. Its IUPAC name is 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide.

Molecular Properties

Compound Name4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide
PubChem CID138025333
Molecular FormulaC15H23F3N2O2
Molecular Weight320.36 g/mol
Exact Mass320.17
IUPAC Name4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide
SMILESO=C(NC(C1CC1)C(F)(F)F)N1CCC(O)(C2CCC2)CC1
InChIInChI=1S/C15H23F3N2O2/c16-15(17,18)12(10-4-5-10)19-13(21)20-8-6-14(22,7-9-20)11-2-1-3-11/h10-12,22H,1-9H2,(H,19,21)
InChIKeyRLFOIDJPXHUTCR-UHFFFAOYSA-N
XLogP2.66
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide?
The IUPAC name of 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide (CID 138025333) is 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide.
What is the SMILES notation for 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide?
The canonical SMILES for 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide is O=C(NC(C1CC1)C(F)(F)F)N1CCC(O)(C2CCC2)CC1.
What is the InChIKey of 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide?
The InChIKey is RLFOIDJPXHUTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23F3N2O2/c16-15(17,18)12(10-4-5-10)19-13(21)20-8-6-14(22,7-9-20)11-2-1-3-11/h10-12,22H,1-9H2,(H,19,21).
What are the key properties of 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide?
4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide has a molecular weight of 320.36 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-hydroxypiperidine-1-carboxamide is sourced from PubChem (CID 138025333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).