1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine

C9H16N4 — CID 83846561

IUPAC1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine
SMILESCN1Cc2c(N)nn(C)c2C1(C)C
InChIInChI=1S/C9H16N4/c1-9(2)7-6(5-12(9)3)8(10)11-13(7)4/h5H2,1-4H3,(H2,10,11)
InChIKeyCJDPMQDUAPKJJE-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.68
Rot. Bonds

About 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine

1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine (PubChem CID 83846561) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine.

Molecular Properties

Compound Name1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine
PubChem CID83846561
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine
SMILESCN1Cc2c(N)nn(C)c2C1(C)C
InChIInChI=1S/C9H16N4/c1-9(2)7-6(5-12(9)3)8(10)11-13(7)4/h5H2,1-4H3,(H2,10,11)
InChIKeyCJDPMQDUAPKJJE-UHFFFAOYSA-N
XLogP0.68
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine?
The IUPAC name of 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine (CID 83846561) is 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine.
What is the SMILES notation for 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine?
The canonical SMILES for 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine is CN1Cc2c(N)nn(C)c2C1(C)C.
What is the InChIKey of 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine?
The InChIKey is CJDPMQDUAPKJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-9(2)7-6(5-12(9)3)8(10)11-13(7)4/h5H2,1-4H3,(H2,10,11).
What are the key properties of 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine?
1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine has a molecular weight of 180.25 g/mol, XLogP of 0.68, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,6,6-tetramethyl-4H-pyrrolo[3,4-d]pyrazol-3-amine is sourced from PubChem (CID 83846561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).