2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine

C13H13N5O — CID 46994283

IUPAC2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCc1nc2c(NCCc3ccccn3)ncnc2o1
InChIInChI=1S/C13H13N5O/c1-9-18-11-12(16-8-17-13(11)19-9)15-7-5-10-4-2-3-6-14-10/h2-4,6,8H,5,7H2,1H3,(H,15,16,17)
InChIKeyDUQVOPFNIAWTLR-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.98
Rot. Bonds4

About 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine

2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (PubChem CID 46994283) has the molecular formula C13H13N5O and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.

Molecular Properties

Compound Name2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
PubChem CID46994283
Molecular FormulaC13H13N5O
Molecular Weight255.28 g/mol
Exact Mass255.11
IUPAC Name2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCc1nc2c(NCCc3ccccn3)ncnc2o1
InChIInChI=1S/C13H13N5O/c1-9-18-11-12(16-8-17-13(11)19-9)15-7-5-10-4-2-3-6-14-10/h2-4,6,8H,5,7H2,1H3,(H,15,16,17)
InChIKeyDUQVOPFNIAWTLR-UHFFFAOYSA-N
XLogP1.98
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine with MolForge

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Related Compounds

6-hydrazinyl-5-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80932540
6-N-methyl-5-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80766055
5-bromo-2-N-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 80765776
4,6-dichloro-N-(2-pyridin-2-ylethyl)-1,3,5-triazin-2-amine
CID 58508167
3-chloro-N-(2-pyridin-2-ylethyl)quinoxalin-2-amine
CID 23770473
3,5-dichloro-2-N-ethyl-6-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
CID 102755416
N-methyl-2-pyridin-2-ylethanamine dichloride
CID 45114105
3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 112675532
2,6-dimethyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 60725788
N-(2-pyridin-2-ylethyl)pyrazin-2-amine
CID 28544593
2-N-(2-pyridin-2-ylethyl)pyrimidine-2,4-diamine
CID 115978124
2,5-dimethyl-N-(2-pyridin-2-ylethyl)aniline
CID 60720537

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The IUPAC name of 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (CID 46994283) is 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.
What is the SMILES notation for 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The canonical SMILES for 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is Cc1nc2c(NCCc3ccccn3)ncnc2o1.
What is the InChIKey of 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The InChIKey is DUQVOPFNIAWTLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O/c1-9-18-11-12(16-8-17-13(11)19-9)15-7-5-10-4-2-3-6-14-10/h2-4,6,8H,5,7H2,1H3,(H,15,16,17).
What are the key properties of 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine has a molecular weight of 255.28 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is sourced from PubChem (CID 46994283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).