6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine

C18H24N6O — CID 70774744

IUPAC6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1noc(C)c1CN(C)c1nc(C2CCCC2)nc2c1cnn2C
InChIInChI=1S/C18H24N6O/c1-11-15(12(2)25-22-11)10-23(3)17-14-9-19-24(4)18(14)21-16(20-17)13-7-5-6-8-13/h9,13H,5-8,10H2,1-4H3
InChIKeyWGUDNULULXRCDX-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.26
Rot. Bonds4

About 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine

6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 70774744) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID70774744
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1noc(C)c1CN(C)c1nc(C2CCCC2)nc2c1cnn2C
InChIInChI=1S/C18H24N6O/c1-11-15(12(2)25-22-11)10-23(3)17-14-9-19-24(4)18(14)21-16(20-17)13-7-5-6-8-13/h9,13H,5-8,10H2,1-4H3
InChIKeyWGUDNULULXRCDX-UHFFFAOYSA-N
XLogP3.26
TPSA72.87 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine (CID 70774744) is 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine is Cc1noc(C)c1CN(C)c1nc(C2CCCC2)nc2c1cnn2C.
What is the InChIKey of 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is WGUDNULULXRCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-11-15(12(2)25-22-11)10-23(3)17-14-9-19-24(4)18(14)21-16(20-17)13-7-5-6-8-13/h9,13H,5-8,10H2,1-4H3.
What are the key properties of 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine?
6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 340.43 g/mol, XLogP of 3.26, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,1-dimethylpyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 70774744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).