2-(aminomethyl)-1,3-oxazol-5-amine

C4H7N3O — CID 70467643

IUPAC2-(aminomethyl)-1,3-oxazol-5-amine
SMILESNCc1ncc(N)o1
InChIInChI=1S/C4H7N3O/c5-1-4-7-2-3(6)8-4/h2H,1,5-6H2
InChIKeyYIJNLBQWGVEKCF-UHFFFAOYSA-N
MW113.12 g/mol
LogP-0.28
Rot. Bonds1

About 2-(aminomethyl)-1,3-oxazol-5-amine

2-(aminomethyl)-1,3-oxazol-5-amine (PubChem CID 70467643) has the molecular formula C4H7N3O and a molecular weight of 113.12 g/mol. Its IUPAC name is 2-(aminomethyl)-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-(aminomethyl)-1,3-oxazol-5-amine
PubChem CID70467643
Molecular FormulaC4H7N3O
Molecular Weight113.12 g/mol
Exact Mass113.06
IUPAC Name2-(aminomethyl)-1,3-oxazol-5-amine
SMILESNCc1ncc(N)o1
InChIInChI=1S/C4H7N3O/c5-1-4-7-2-3(6)8-4/h2H,1,5-6H2
InChIKeyYIJNLBQWGVEKCF-UHFFFAOYSA-N
XLogP-0.28
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-1,3-oxazol-5-amine?
The IUPAC name of 2-(aminomethyl)-1,3-oxazol-5-amine (CID 70467643) is 2-(aminomethyl)-1,3-oxazol-5-amine.
What is the SMILES notation for 2-(aminomethyl)-1,3-oxazol-5-amine?
The canonical SMILES for 2-(aminomethyl)-1,3-oxazol-5-amine is NCc1ncc(N)o1.
What is the InChIKey of 2-(aminomethyl)-1,3-oxazol-5-amine?
The InChIKey is YIJNLBQWGVEKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O/c5-1-4-7-2-3(6)8-4/h2H,1,5-6H2.
What are the key properties of 2-(aminomethyl)-1,3-oxazol-5-amine?
2-(aminomethyl)-1,3-oxazol-5-amine has a molecular weight of 113.12 g/mol, XLogP of -0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-1,3-oxazol-5-amine is sourced from PubChem (CID 70467643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).