2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine

C7H12N2O — CID 96637249

IUPAC2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine
SMILESCc1ocnc1C(C)(C)N
InChIInChI=1S/C7H12N2O/c1-5-6(7(2,3)8)9-4-10-5/h4H,8H2,1-3H3
InChIKeyPTIWVNYQOJILJJ-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.18
Rot. Bonds1

About 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine

2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine (PubChem CID 96637249) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine.

Molecular Properties

Compound Name2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine
PubChem CID96637249
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine
SMILESCc1ocnc1C(C)(C)N
InChIInChI=1S/C7H12N2O/c1-5-6(7(2,3)8)9-4-10-5/h4H,8H2,1-3H3
InChIKeyPTIWVNYQOJILJJ-UHFFFAOYSA-N
XLogP1.18
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine?
The IUPAC name of 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine (CID 96637249) is 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine.
What is the SMILES notation for 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine?
The canonical SMILES for 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine is Cc1ocnc1C(C)(C)N.
What is the InChIKey of 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine?
The InChIKey is PTIWVNYQOJILJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5-6(7(2,3)8)9-4-10-5/h4H,8H2,1-3H3.
What are the key properties of 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine?
2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine has a molecular weight of 140.19 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,3-oxazol-4-yl)propan-2-amine is sourced from PubChem (CID 96637249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).