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

C18H22N6O2 — CID 46986087

IUPAC2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCc1nc(NCC(c2ccccn2)N2CCOCC2)c2nc(C)oc2n1
InChIInChI=1S/C18H22N6O2/c1-12-21-17(16-18(22-12)26-13(2)23-16)20-11-15(14-5-3-4-6-19-14)24-7-9-25-10-8-24/h3-6,15H,7-11H2,1-2H3,(H,20,21,22)
InChIKeyHKJRICRAVXXVJB-UHFFFAOYSA-N
MW354.41 g/mol
LogP2.12
Rot. Bonds5

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

2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (PubChem CID 46986087) has the molecular formula C18H22N6O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
PubChem CID46986087
Molecular FormulaC18H22N6O2
Molecular Weight354.41 g/mol
Exact Mass354.18
IUPAC Name2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
SMILESCc1nc(NCC(c2ccccn2)N2CCOCC2)c2nc(C)oc2n1
InChIInChI=1S/C18H22N6O2/c1-12-21-17(16-18(22-12)26-13(2)23-16)20-11-15(14-5-3-4-6-19-14)24-7-9-25-10-8-24/h3-6,15H,7-11H2,1-2H3,(H,20,21,22)
InChIKeyHKJRICRAVXXVJB-UHFFFAOYSA-N
XLogP2.12
TPSA89.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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

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Related Compounds

2-morpholin-4-yl-2-pyridin-2-ylethanol
CID 91095032
N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]-4-pyridin-4-ylpyrimidin-2-amine
CID 97443802
5-methyl-4-(2-methyl-1,2,4-triazol-3-yl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]pyrimidin-2-amine
CID 31191896
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-1H-pyrrolo[2,3-b]pyridin-6-amine
CID 56888620
6-methoxy-N-[(2S)-2-morpholin-4-yl-2-pyridin-2-ylethyl]pyrimidin-4-amine
CID 95132901
N-[(2S)-2-morpholin-4-yl-2-pyridin-2-ylethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 96571971
1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea
CID 119060016
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
CID 131898064
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine
CID 131893880
5-hydroxy-N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]pyridine-2-carboxamide
CID 99941083
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 70776358
4-hydroxy-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 77094687

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The IUPAC name of 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine (CID 46986087) is 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine.
What is the SMILES notation for 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The canonical SMILES for 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is Cc1nc(NCC(c2ccccn2)N2CCOCC2)c2nc(C)oc2n1.
What is the InChIKey of 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
The InChIKey is HKJRICRAVXXVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O2/c1-12-21-17(16-18(22-12)26-13(2)23-16)20-11-15(14-5-3-4-6-19-14)24-7-9-25-10-8-24/h3-6,15H,7-11H2,1-2H3,(H,20,21,22).
What are the key properties of 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine?
2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine has a molecular weight of 354.41 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine is sourced from PubChem (CID 46986087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).