1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine

C12H19N5 — CID 22590066

IUPAC1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCCCN(CCC)c1ncnc2c1cnn2C
InChIInChI=1S/C12H19N5/c1-4-6-17(7-5-2)12-10-8-15-16(3)11(10)13-9-14-12/h8-9H,4-7H2,1-3H3
InChIKeyVVYVZUXBMFJEKI-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.99
Rot. Bonds5

About 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine

1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 22590066) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID22590066
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine
SMILESCCCN(CCC)c1ncnc2c1cnn2C
InChIInChI=1S/C12H19N5/c1-4-6-17(7-5-2)12-10-8-15-16(3)11(10)13-9-14-12/h8-9H,4-7H2,1-3H3
InChIKeyVVYVZUXBMFJEKI-UHFFFAOYSA-N
XLogP1.99
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine (CID 22590066) is 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine is CCCN(CCC)c1ncnc2c1cnn2C.
What is the InChIKey of 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is VVYVZUXBMFJEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-4-6-17(7-5-2)12-10-8-15-16(3)11(10)13-9-14-12/h8-9H,4-7H2,1-3H3.
What are the key properties of 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine?
1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 233.32 g/mol, XLogP of 1.99, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N,N-dipropylpyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 22590066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).