4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol

C19H21N5O2 — CID 56743851

IUPAC4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(Cc3nnc(-c4cccnc4)o3)CC2)nc1
InChIInChI=1S/C19H21N5O2/c1-14-4-5-16(21-11-14)19(25)6-9-24(10-7-19)13-17-22-23-18(26-17)15-3-2-8-20-12-15/h2-5,8,11-12,25H,6-7,9-10,13H2,1H3
InChIKeyMSVHENLPOXVYJL-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.32
Rot. Bonds4

About 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol

4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol (PubChem CID 56743851) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol
PubChem CID56743851
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(Cc3nnc(-c4cccnc4)o3)CC2)nc1
InChIInChI=1S/C19H21N5O2/c1-14-4-5-16(21-11-14)19(25)6-9-24(10-7-19)13-17-22-23-18(26-17)15-3-2-8-20-12-15/h2-5,8,11-12,25H,6-7,9-10,13H2,1H3
InChIKeyMSVHENLPOXVYJL-UHFFFAOYSA-N
XLogP2.32
TPSA88.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol?
The IUPAC name of 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol (CID 56743851) is 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol?
The canonical SMILES for 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol is Cc1ccc(C2(O)CCN(Cc3nnc(-c4cccnc4)o3)CC2)nc1.
What is the InChIKey of 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol?
The InChIKey is MSVHENLPOXVYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-14-4-5-16(21-11-14)19(25)6-9-24(10-7-19)13-17-22-23-18(26-17)15-3-2-8-20-12-15/h2-5,8,11-12,25H,6-7,9-10,13H2,1H3.
What are the key properties of 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol?
4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol has a molecular weight of 351.41 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-2-pyridinyl)-1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 56743851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).