6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine

C18H24N8O — CID 56900655

IUPAC6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine
SMILESCc1noc(C)c1CN(C)Cc1cc2n(n1)CCN(c1cc(N)ncn1)C2
InChIInChI=1S/C18H24N8O/c1-12-16(13(2)27-23-12)10-24(3)8-14-6-15-9-25(4-5-26(15)22-14)18-7-17(19)20-11-21-18/h6-7,11H,4-5,8-10H2,1-3H3,(H2,19,20,21)
InChIKeyUIAMVAYKSCWAMB-UHFFFAOYSA-N
MW368.45 g/mol
LogP1.51
Rot. Bonds5

About 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine

6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine (PubChem CID 56900655) has the molecular formula C18H24N8O and a molecular weight of 368.45 g/mol. Its IUPAC name is 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine
PubChem CID56900655
Molecular FormulaC18H24N8O
Molecular Weight368.45 g/mol
Exact Mass368.21
IUPAC Name6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine
SMILESCc1noc(C)c1CN(C)Cc1cc2n(n1)CCN(c1cc(N)ncn1)C2
InChIInChI=1S/C18H24N8O/c1-12-16(13(2)27-23-12)10-24(3)8-14-6-15-9-25(4-5-26(15)22-14)18-7-17(19)20-11-21-18/h6-7,11H,4-5,8-10H2,1-3H3,(H2,19,20,21)
InChIKeyUIAMVAYKSCWAMB-UHFFFAOYSA-N
XLogP1.51
TPSA102.13 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine?
The IUPAC name of 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine (CID 56900655) is 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine.
What is the SMILES notation for 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine?
The canonical SMILES for 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine is Cc1noc(C)c1CN(C)Cc1cc2n(n1)CCN(c1cc(N)ncn1)C2.
What is the InChIKey of 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine?
The InChIKey is UIAMVAYKSCWAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N8O/c1-12-16(13(2)27-23-12)10-24(3)8-14-6-15-9-25(4-5-26(15)22-14)18-7-17(19)20-11-21-18/h6-7,11H,4-5,8-10H2,1-3H3,(H2,19,20,21).
What are the key properties of 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine?
6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine has a molecular weight of 368.45 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine is sourced from PubChem (CID 56900655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).