3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine

C20H17N5O2 — CID 53312317

IUPAC3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine
SMILESCOc1ccc(-c2cc(-c3ccc(-c4nnc(C)o4)cc3)cnc2N)cn1
InChIInChI=1S/C20H17N5O2/c1-12-24-25-20(27-12)14-5-3-13(4-6-14)16-9-17(19(21)23-11-16)15-7-8-18(26-2)22-10-15/h3-11H,1-2H3,(H2,21,23)
InChIKeyVQEDNCKIUDHQGN-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.76
Rot. Bonds4

About 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine

3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine (PubChem CID 53312317) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine
PubChem CID53312317
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine
SMILESCOc1ccc(-c2cc(-c3ccc(-c4nnc(C)o4)cc3)cnc2N)cn1
InChIInChI=1S/C20H17N5O2/c1-12-24-25-20(27-12)14-5-3-13(4-6-14)16-9-17(19(21)23-11-16)15-7-8-18(26-2)22-10-15/h3-11H,1-2H3,(H2,21,23)
InChIKeyVQEDNCKIUDHQGN-UHFFFAOYSA-N
XLogP3.76
TPSA99.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine with MolForge

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Related Compounds

4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N,N-dimethyl-benzamide
CID 53312066
[4-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]phenyl]-(4-methylpiperazin-1-yl)methanone
CID 53311068
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-methyl-benzamide
CID 53312149
[4-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]phenyl]-morpholino-methanone
CID 53312150
4-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]benzamide
CID 53312151
4-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]benzoic acid
CID 53312152
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-(3-hydroxypropyl)benzamide
CID 53312232
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-(2-morpholinoethyl)benzamide
CID 53312237
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 53312321
3-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)-5-[4-(morpholin-4-ylmethyl)phenyl]pyridin-2-amine
CID 77105957
3-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]benzamide
CID 53312316
4-(2-Amino-5-(3-methoxyphenyl)pyridin-3-yl)benzamide
CID 46230038

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine?
The IUPAC name of 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine (CID 53312317) is 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine.
What is the SMILES notation for 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine?
The canonical SMILES for 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine is COc1ccc(-c2cc(-c3ccc(-c4nnc(C)o4)cc3)cnc2N)cn1.
What is the InChIKey of 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine?
The InChIKey is VQEDNCKIUDHQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c1-12-24-25-20(27-12)14-5-3-13(4-6-14)16-9-17(19(21)23-11-16)15-7-8-18(26-2)22-10-15/h3-11H,1-2H3,(H2,21,23).
What are the key properties of 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine?
3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine has a molecular weight of 359.39 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-3-pyridinyl)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridin-2-amine is sourced from PubChem (CID 53312317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).