N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine

C15H17N5O — CID 46996093

IUPACN-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCCN(Cc1ccncc1)c1nc(C)nc2oc(C)nc12
InChIInChI=1S/C15H17N5O/c1-4-20(9-12-5-7-16-8-6-12)14-13-15(18-10(2)17-14)21-11(3)19-13/h5-8H,4,9H2,1-3H3
InChIKeyMEYKCCOGNJUTDL-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.66
Rot. Bonds4

About N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine

N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (PubChem CID 46996093) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.

Molecular Properties

Compound NameN-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
PubChem CID46996093
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC NameN-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCCN(Cc1ccncc1)c1nc(C)nc2oc(C)nc12
InChIInChI=1S/C15H17N5O/c1-4-20(9-12-5-7-16-8-6-12)14-13-15(18-10(2)17-14)21-11(3)19-13/h5-8H,4,9H2,1-3H3
InChIKeyMEYKCCOGNJUTDL-UHFFFAOYSA-N
XLogP2.66
TPSA67.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-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 N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The IUPAC name of N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (CID 46996093) is N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.
What is the SMILES notation for N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The canonical SMILES for N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is CCN(Cc1ccncc1)c1nc(C)nc2oc(C)nc12.
What is the InChIKey of N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The InChIKey is MEYKCCOGNJUTDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-4-20(9-12-5-7-16-8-6-12)14-13-15(18-10(2)17-14)21-11(3)19-13/h5-8H,4,9H2,1-3H3.
What are the key properties of N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine has a molecular weight of 283.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dimethyl-N-(pyridin-4-ylmethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is sourced from PubChem (CID 46996093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).