(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide

C15H18FN5O2 — CID 99597501

IUPAC(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
SMILESCc1nc(C[C@H]2CCCN(C(=O)Nc3ccc(F)cn3)C2)no1
InChIInChI=1S/C15H18FN5O2/c1-10-18-14(20-23-10)7-11-3-2-6-21(9-11)15(22)19-13-5-4-12(16)8-17-13/h4-5,8,11H,2-3,6-7,9H2,1H3,(H,17,19,22)/t11-/m1/s1
InChIKeyOAWFJJFNYXFCBW-LLVKDONJSA-N
MW319.34 g/mol
LogP2.40
Rot. Bonds3

About (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide

(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide (PubChem CID 99597501) has the molecular formula C15H18FN5O2 and a molecular weight of 319.34 g/mol. Its IUPAC name is (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
PubChem CID99597501
Molecular FormulaC15H18FN5O2
Molecular Weight319.34 g/mol
Exact Mass319.14
IUPAC Name(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
SMILESCc1nc(C[C@H]2CCCN(C(=O)Nc3ccc(F)cn3)C2)no1
InChIInChI=1S/C15H18FN5O2/c1-10-18-14(20-23-10)7-11-3-2-6-21(9-11)15(22)19-13-5-4-12(16)8-17-13/h4-5,8,11H,2-3,6-7,9H2,1H3,(H,17,19,22)/t11-/m1/s1
InChIKeyOAWFJJFNYXFCBW-LLVKDONJSA-N
XLogP2.40
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide?
The IUPAC name of (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide (CID 99597501) is (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide?
The canonical SMILES for (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide is Cc1nc(C[C@H]2CCCN(C(=O)Nc3ccc(F)cn3)C2)no1.
What is the InChIKey of (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide?
The InChIKey is OAWFJJFNYXFCBW-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18FN5O2/c1-10-18-14(20-23-10)7-11-3-2-6-21(9-11)15(22)19-13-5-4-12(16)8-17-13/h4-5,8,11H,2-3,6-7,9H2,1H3,(H,17,19,22)/t11-/m1/s1.
What are the key properties of (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide?
(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide has a molecular weight of 319.34 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 99597501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).