(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine

C10H15N5O — CID 79584759

IUPAC(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCCc1nc(C(N)c2cnn(C)c2C)no1
InChIInChI=1S/C10H15N5O/c1-4-8-13-10(14-16-8)9(11)7-5-12-15(3)6(7)2/h5,9H,4,11H2,1-3H3
InChIKeyZKJMYRUQTVWCTN-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.72
Rot. Bonds3

About (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine

(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine (PubChem CID 79584759) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine
PubChem CID79584759
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCCc1nc(C(N)c2cnn(C)c2C)no1
InChIInChI=1S/C10H15N5O/c1-4-8-13-10(14-16-8)9(11)7-5-12-15(3)6(7)2/h5,9H,4,11H2,1-3H3
InChIKeyZKJMYRUQTVWCTN-UHFFFAOYSA-N
XLogP0.72
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine?
The IUPAC name of (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine (CID 79584759) is (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine.
What is the SMILES notation for (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine?
The canonical SMILES for (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine is CCc1nc(C(N)c2cnn(C)c2C)no1.
What is the InChIKey of (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine?
The InChIKey is ZKJMYRUQTVWCTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-4-8-13-10(14-16-8)9(11)7-5-12-15(3)6(7)2/h5,9H,4,11H2,1-3H3.
What are the key properties of (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine?
(1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine has a molecular weight of 221.26 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-4-yl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine is sourced from PubChem (CID 79584759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).