5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

C19H21N5O2 — CID 77105958

IUPAC5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCOc1cccc(-c2cnc(N)c(-c3nnc(C4CCNCC4)o3)c2)c1
InChIInChI=1S/C19H21N5O2/c1-25-15-4-2-3-13(9-15)14-10-16(17(20)22-11-14)19-24-23-18(26-19)12-5-7-21-8-6-12/h2-4,9-12,21H,5-8H2,1H3,(H2,20,22)
InChIKeyWMBKIBJNGAEFNA-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.86
Rot. Bonds4

About 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (PubChem CID 77105958) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
PubChem CID77105958
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCOc1cccc(-c2cnc(N)c(-c3nnc(C4CCNCC4)o3)c2)c1
InChIInChI=1S/C19H21N5O2/c1-25-15-4-2-3-13(9-15)14-10-16(17(20)22-11-14)19-24-23-18(26-19)12-5-7-21-8-6-12/h2-4,9-12,21H,5-8H2,1H3,(H2,20,22)
InChIKeyWMBKIBJNGAEFNA-UHFFFAOYSA-N
XLogP2.86
TPSA99.09 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-{4-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-N-[4-(trifluoromethoxy)phenyl]-1,3,4-oxadiazol-2-amine
CID 23644884
N-(3-methoxyphenyl)-5-{2-[2-(pyridin-4-yl)ethyl]pyridin-3-yl}-1,3,4-oxadiazol-2-amine
CID 23644890
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-[4-(morpholin-4-ylmethyl)phenyl]pyridin-2-amine
CID 77105957
3-(6-Methoxy-3-pyridyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine
CID 53312317
Pyrrolo-pyrimidone, 5
CID 135874061
Diethyl-[3-[[5-[5-(4-isobutoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-pyridyl]amino]propyl]amine
CID 2526579
3-(5-(1-Methylpiperidin-4-yl)-1,3,4-oxadiazol-2-yl)-5-(p-tolyl)pyridin-2-amine
CID 77105955
5-(3-Methoxy-phenyl)-3-[5-(1-methyl-piperidin-4-yl)-[1,3,4]oxadiazol-2-yl]-pyridin-2-ylamine
CID 77105959
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(3-(morpholinomethyl)phenyl)pyridin-2-amine
CID 77106564
(S)-2-(3-(Aminomethyl)pyrrolidin-1-yl)-6'-methoxy-N-(4-(trifluoromethoxy)phenyl)-[3,3'-bipyridine]-5-carboxamide
CID 118195123
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(4-methylphenyl)pyridin-2-amine
CID 137636366
N-cyclohexyl-1-[5-methyl-3-(5-methylfuran-2-yl)-2-pyridinyl]piperidin-4-amine
CID 118264075

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The IUPAC name of 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (CID 77105958) is 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is COc1cccc(-c2cnc(N)c(-c3nnc(C4CCNCC4)o3)c2)c1.
What is the InChIKey of 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The InChIKey is WMBKIBJNGAEFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-25-15-4-2-3-13(9-15)14-10-16(17(20)22-11-14)19-24-23-18(26-19)12-5-7-21-8-6-12/h2-4,9-12,21H,5-8H2,1H3,(H2,20,22).
What are the key properties of 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine has a molecular weight of 351.41 g/mol, XLogP of 2.86, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxyphenyl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 77105958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).