1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine

C10H15N5O — CID 103893752

IUPAC1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine
SMILESCc1cnc(C(C)NCc2ncnn2C)o1
InChIInChI=1S/C10H15N5O/c1-7-4-12-10(16-7)8(2)11-5-9-13-6-14-15(9)3/h4,6,8,11H,5H2,1-3H3
InChIKeyZNCLRZQPCHRDTH-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.96
Rot. Bonds4

About 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine

1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine (PubChem CID 103893752) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine
PubChem CID103893752
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine
SMILESCc1cnc(C(C)NCc2ncnn2C)o1
InChIInChI=1S/C10H15N5O/c1-7-4-12-10(16-7)8(2)11-5-9-13-6-14-15(9)3/h4,6,8,11H,5H2,1-3H3
InChIKeyZNCLRZQPCHRDTH-UHFFFAOYSA-N
XLogP0.96
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine?
The IUPAC name of 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine (CID 103893752) is 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine.
What is the SMILES notation for 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine?
The canonical SMILES for 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine is Cc1cnc(C(C)NCc2ncnn2C)o1.
What is the InChIKey of 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine?
The InChIKey is ZNCLRZQPCHRDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-7-4-12-10(16-7)8(2)11-5-9-13-6-14-15(9)3/h4,6,8,11H,5H2,1-3H3.
What are the key properties of 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine?
1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine has a molecular weight of 221.26 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,3-oxazol-2-yl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]ethanamine is sourced from PubChem (CID 103893752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).