4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide

C17H23FN2O2 — CID 23071926

IUPAC4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(O)(C2CCCC2)CC1
InChIInChI=1S/C17H23FN2O2/c18-14-6-3-7-15(12-14)19-16(21)20-10-8-17(22,9-11-20)13-4-1-2-5-13/h3,6-7,12-13,22H,1-2,4-5,8-11H2,(H,19,21)
InChIKeyMZGIMGKWHQJXQO-UHFFFAOYSA-N
MW306.38 g/mol
LogP3.37
Rot. Bonds2

About 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide

4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide (PubChem CID 23071926) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide
PubChem CID23071926
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC Name4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(O)(C2CCCC2)CC1
InChIInChI=1S/C17H23FN2O2/c18-14-6-3-7-15(12-14)19-16(21)20-10-8-17(22,9-11-20)13-4-1-2-5-13/h3,6-7,12-13,22H,1-2,4-5,8-11H2,(H,19,21)
InChIKeyMZGIMGKWHQJXQO-UHFFFAOYSA-N
XLogP3.37
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide?
The IUPAC name of 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide (CID 23071926) is 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(O)(C2CCCC2)CC1.
What is the InChIKey of 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide?
The InChIKey is MZGIMGKWHQJXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c18-14-6-3-7-15(12-14)19-16(21)20-10-8-17(22,9-11-20)13-4-1-2-5-13/h3,6-7,12-13,22H,1-2,4-5,8-11H2,(H,19,21).
What are the key properties of 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide?
4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide has a molecular weight of 306.38 g/mol, XLogP of 3.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-(3-fluorophenyl)-4-hydroxypiperidine-1-carboxamide is sourced from PubChem (CID 23071926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).