3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

C11H15N5O — CID 63277050

IUPAC3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
SMILESCc1noc2ncnc(NCC3CCCN3)c12
InChIInChI=1S/C11H15N5O/c1-7-9-10(13-5-8-3-2-4-12-8)14-6-15-11(9)17-16-7/h6,8,12H,2-5H2,1H3,(H,13,14,15)
InChIKeyZIEBEKNUHVNCMF-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.09
Rot. Bonds3

About 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine (PubChem CID 63277050) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
PubChem CID63277050
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
SMILESCc1noc2ncnc(NCC3CCCN3)c12
InChIInChI=1S/C11H15N5O/c1-7-9-10(13-5-8-3-2-4-12-8)14-6-15-11(9)17-16-7/h6,8,12H,2-5H2,1H3,(H,13,14,15)
InChIKeyZIEBEKNUHVNCMF-UHFFFAOYSA-N
XLogP1.09
TPSA75.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine (CID 63277050) is 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine is Cc1noc2ncnc(NCC3CCCN3)c12.
What is the InChIKey of 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is ZIEBEKNUHVNCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-7-9-10(13-5-8-3-2-4-12-8)14-6-15-11(9)17-16-7/h6,8,12H,2-5H2,1H3,(H,13,14,15).
What are the key properties of 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 233.27 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(pyrrolidin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 63277050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).