4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine

C11H17N5O — CID 70835820

IUPAC4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine
SMILESCOc1nc(N(C)C)nc2c1cnn2C(C)C
InChIInChI=1S/C11H17N5O/c1-7(2)16-9-8(6-12-16)10(17-5)14-11(13-9)15(3)4/h6-7H,1-5H3
InChIKeyLLWOGHNSZCMTAX-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.48
Rot. Bonds3

About 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine

4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine (PubChem CID 70835820) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine.

Molecular Properties

Compound Name4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine
PubChem CID70835820
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine
SMILESCOc1nc(N(C)C)nc2c1cnn2C(C)C
InChIInChI=1S/C11H17N5O/c1-7(2)16-9-8(6-12-16)10(17-5)14-11(13-9)15(3)4/h6-7H,1-5H3
InChIKeyLLWOGHNSZCMTAX-UHFFFAOYSA-N
XLogP1.48
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The IUPAC name of 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine (CID 70835820) is 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine.
What is the SMILES notation for 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The canonical SMILES for 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine is COc1nc(N(C)C)nc2c1cnn2C(C)C.
What is the InChIKey of 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The InChIKey is LLWOGHNSZCMTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-7(2)16-9-8(6-12-16)10(17-5)14-11(13-9)15(3)4/h6-7H,1-5H3.
What are the key properties of 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine?
4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine has a molecular weight of 235.29 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethyl-1-propan-2-ylpyrazolo[5,4-d]pyrimidin-6-amine is sourced from PubChem (CID 70835820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).