4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine

C11H14N4O — CID 103761486

IUPAC4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine
SMILESCc1ccnc(NCCc2nc(C)no2)c1
InChIInChI=1S/C11H14N4O/c1-8-3-5-12-10(7-8)13-6-4-11-14-9(2)15-16-11/h3,5,7H,4,6H2,1-2H3,(H,12,13)
InChIKeySNTQTILUGOFJDJ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.74
Rot. Bonds4

About 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine

4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine (PubChem CID 103761486) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine
PubChem CID103761486
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine
SMILESCc1ccnc(NCCc2nc(C)no2)c1
InChIInChI=1S/C11H14N4O/c1-8-3-5-12-10(7-8)13-6-4-11-14-9(2)15-16-11/h3,5,7H,4,6H2,1-2H3,(H,12,13)
InChIKeySNTQTILUGOFJDJ-UHFFFAOYSA-N
XLogP1.74
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine (CID 103761486) is 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine is Cc1ccnc(NCCc2nc(C)no2)c1.
What is the InChIKey of 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine?
The InChIKey is SNTQTILUGOFJDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-3-5-12-10(7-8)13-6-4-11-14-9(2)15-16-11/h3,5,7H,4,6H2,1-2H3,(H,12,13).
What are the key properties of 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine?
4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine has a molecular weight of 218.26 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 103761486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).