3-propyl-1,2-oxazol-5-amine

C6H10N2O — CID 2104061

IUPAC3-propyl-1,2-oxazol-5-amine
SMILESCCCc1cc(N)on1
InChIInChI=1S/C6H10N2O/c1-2-3-5-4-6(7)9-8-5/h4H,2-3,7H2,1H3
InChIKeyNORVABBMTGHGCF-UHFFFAOYSA-N
MW126.16 g/mol
LogP1.21
Rot. Bonds2

About 3-propyl-1,2-oxazol-5-amine

3-propyl-1,2-oxazol-5-amine (PubChem CID 2104061) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 3-propyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-propyl-1,2-oxazol-5-amine
PubChem CID2104061
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name3-propyl-1,2-oxazol-5-amine
SMILESCCCc1cc(N)on1
InChIInChI=1S/C6H10N2O/c1-2-3-5-4-6(7)9-8-5/h4H,2-3,7H2,1H3
InChIKeyNORVABBMTGHGCF-UHFFFAOYSA-N
XLogP1.21
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-propyl-1,2-oxazol-5-amine?
The IUPAC name of 3-propyl-1,2-oxazol-5-amine (CID 2104061) is 3-propyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-propyl-1,2-oxazol-5-amine?
The canonical SMILES for 3-propyl-1,2-oxazol-5-amine is CCCc1cc(N)on1.
What is the InChIKey of 3-propyl-1,2-oxazol-5-amine?
The InChIKey is NORVABBMTGHGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-3-5-4-6(7)9-8-5/h4H,2-3,7H2,1H3.
What are the key properties of 3-propyl-1,2-oxazol-5-amine?
3-propyl-1,2-oxazol-5-amine has a molecular weight of 126.16 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propyl-1,2-oxazol-5-amine is sourced from PubChem (CID 2104061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).