6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine

C15H24N6 — CID 63220443

IUPAC6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCNc1nc(CN(C)C(C)C2CC2)nc2c1cnn2C
InChIInChI=1S/C15H24N6/c1-5-16-14-12-8-17-21(4)15(12)19-13(18-14)9-20(3)10(2)11-6-7-11/h8,10-11H,5-7,9H2,1-4H3,(H,16,18,19)
InChIKeyDNSXAIICFIMYLV-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.03
Rot. Bonds6

About 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine

6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 63220443) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID63220443
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCNc1nc(CN(C)C(C)C2CC2)nc2c1cnn2C
InChIInChI=1S/C15H24N6/c1-5-16-14-12-8-17-21(4)15(12)19-13(18-14)9-20(3)10(2)11-6-7-11/h8,10-11H,5-7,9H2,1-4H3,(H,16,18,19)
InChIKeyDNSXAIICFIMYLV-UHFFFAOYSA-N
XLogP2.03
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine (CID 63220443) is 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine is CCNc1nc(CN(C)C(C)C2CC2)nc2c1cnn2C.
What is the InChIKey of 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is DNSXAIICFIMYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-5-16-14-12-8-17-21(4)15(12)19-13(18-14)9-20(3)10(2)11-6-7-11/h8,10-11H,5-7,9H2,1-4H3,(H,16,18,19).
What are the key properties of 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine?
6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 288.40 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 63220443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).