N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine

C15H20N6O — CID 70743882

IUPACN,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2ncnc(N(C)Cc3cc(C(C)C)on3)c12
InChIInChI=1S/C15H20N6O/c1-9(2)12-6-11(19-22-12)7-20(4)14-13-10(3)18-21(5)15(13)17-8-16-14/h6,8-9H,7H2,1-5H3
InChIKeyCFAGNIOKOCELJT-UHFFFAOYSA-N
MW300.37 g/mol
LogP2.42
Rot. Bonds4

About N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine

N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 70743882) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID70743882
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC NameN,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2ncnc(N(C)Cc3cc(C(C)C)on3)c12
InChIInChI=1S/C15H20N6O/c1-9(2)12-6-11(19-22-12)7-20(4)14-13-10(3)18-21(5)15(13)17-8-16-14/h6,8-9H,7H2,1-5H3
InChIKeyCFAGNIOKOCELJT-UHFFFAOYSA-N
XLogP2.42
TPSA72.87 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine with MolForge

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Related Compounds

3-(5-Cyclopropyl-1,2-oxazol-3-yl)-1-heptylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126591726
1-Propan-2-yl-3-(5-propan-2-yl-1,2-oxazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 126591906
3-(5-Cyclohexyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126591909
1-[4-Amino-3-(5-cyclopropyl-1,2-oxazol-3-yl)pyrazolo[3,4-d]pyrimidin-1-yl]-2-methylpropan-2-ol
CID 126591918
1-Cyclohexyl-3-(5-cyclopropyl-1,2-oxazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 126591922
3-(5-Cyclopropyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126591927
3-(5-Cyclopentyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126592010
1-Benzyl-3-(5-cyclopropyl-1,2-oxazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 126592025
3-(5-Tert-butyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126592159
3-(5-Cyclopropyl-1,2-oxazol-3-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126592165
3-(5-Ethyl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126592367
3-(1,3-Dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 47040420

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine (CID 70743882) is N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine is Cc1nn(C)c2ncnc(N(C)Cc3cc(C(C)C)on3)c12.
What is the InChIKey of N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is CFAGNIOKOCELJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-9(2)12-6-11(19-22-12)7-20(4)14-13-10(3)18-21(5)15(13)17-8-16-14/h6,8-9H,7H2,1-5H3.
What are the key properties of N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine?
N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 300.37 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 70743882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).