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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Related Compounds

N-(2-fluorocyclopentyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 126857815
N-(1-ethylpiperidin-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 60710802
1-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pyrrolidine-2,5-dione
CID 2809002
3-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66005488
1-methyl-N-(1-methylpyrazol-4-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 43543834
1-methyl-N-(3-methylbutan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 43088482
1-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)azetidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 154575866
N-[1-(aminomethyl)-4-methylcyclohexyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63759090
N-cycloheptyl-N'-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 115306725
N-(2,2-difluoroethyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 79099379
4-cyclopropyl-1-methylpyrazolo[3,4-d]pyrimidine
CID 166783555
N-[[1-(aminomethyl)cyclopropyl]methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 113313719

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).