1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine

C10H13N5 — CID 62397166

IUPAC1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine
SMILESCC1CC1Nc1ncnc2c1cnn2C
InChIInChI=1S/C10H13N5/c1-6-3-8(6)14-9-7-4-13-15(2)10(7)12-5-11-9/h4-6,8H,3H2,1-2H3,(H,11,12,14)
InChIKeyVDSGXHGHWMNHDS-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.18
Rot. Bonds2

About 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine

1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 62397166) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID62397166
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine
SMILESCC1CC1Nc1ncnc2c1cnn2C
InChIInChI=1S/C10H13N5/c1-6-3-8(6)14-9-7-4-13-15(2)10(7)12-5-11-9/h4-6,8H,3H2,1-2H3,(H,11,12,14)
InChIKeyVDSGXHGHWMNHDS-UHFFFAOYSA-N
XLogP1.18
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine (CID 62397166) is 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine is CC1CC1Nc1ncnc2c1cnn2C.
What is the InChIKey of 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is VDSGXHGHWMNHDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-6-3-8(6)14-9-7-4-13-15(2)10(7)12-5-11-9/h4-6,8H,3H2,1-2H3,(H,11,12,14).
What are the key properties of 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine?
1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 203.25 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 62397166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).