1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one

C20H25FN2O3 — CID 24816639

IUPAC1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one
SMILESO=C(C1CCC(=O)N(C2CC2)C1)N1CCC(Oc2ccccc2F)CC1
InChIInChI=1S/C20H25FN2O3/c21-17-3-1-2-4-18(17)26-16-9-11-22(12-10-16)20(25)14-5-8-19(24)23(13-14)15-6-7-15/h1-4,14-16H,5-13H2
InChIKeyGWSQRMBVDPYOPK-UHFFFAOYSA-N
MW360.43 g/mol
LogP2.60
Rot. Bonds4

About 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one

1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one (PubChem CID 24816639) has the molecular formula C20H25FN2O3 and a molecular weight of 360.43 g/mol. Its IUPAC name is 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one
PubChem CID24816639
Molecular FormulaC20H25FN2O3
Molecular Weight360.43 g/mol
Exact Mass360.18
IUPAC Name1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one
SMILESO=C(C1CCC(=O)N(C2CC2)C1)N1CCC(Oc2ccccc2F)CC1
InChIInChI=1S/C20H25FN2O3/c21-17-3-1-2-4-18(17)26-16-9-11-22(12-10-16)20(25)14-5-8-19(24)23(13-14)15-6-7-15/h1-4,14-16H,5-13H2
InChIKeyGWSQRMBVDPYOPK-UHFFFAOYSA-N
XLogP2.60
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.43
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one?
The IUPAC name of 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one (CID 24816639) is 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one.
What is the SMILES notation for 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one?
The canonical SMILES for 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one is O=C(C1CCC(=O)N(C2CC2)C1)N1CCC(Oc2ccccc2F)CC1.
What is the InChIKey of 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one?
The InChIKey is GWSQRMBVDPYOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN2O3/c21-17-3-1-2-4-18(17)26-16-9-11-22(12-10-16)20(25)14-5-8-19(24)23(13-14)15-6-7-15/h1-4,14-16H,5-13H2.
What are the key properties of 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one?
1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one has a molecular weight of 360.43 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-[4-(2-fluorophenoxy)piperidine-1-carbonyl]piperidin-2-one is sourced from PubChem (CID 24816639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).