4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine

C9H16N4 — CID 83846566

IUPAC4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine
SMILESCC(C)N1Cc2[nH]nc(N)c2C1C
InChIInChI=1S/C9H16N4/c1-5(2)13-4-7-8(6(13)3)9(10)12-11-7/h5-6H,4H2,1-3H3,(H3,10,11,12)
InChIKeyRBXYJXCDUGAYAU-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.28
Rot. Bonds1

About 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine

4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine (PubChem CID 83846566) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine
PubChem CID83846566
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine
SMILESCC(C)N1Cc2[nH]nc(N)c2C1C
InChIInChI=1S/C9H16N4/c1-5(2)13-4-7-8(6(13)3)9(10)12-11-7/h5-6H,4H2,1-3H3,(H3,10,11,12)
InChIKeyRBXYJXCDUGAYAU-UHFFFAOYSA-N
XLogP1.28
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine?
The IUPAC name of 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine (CID 83846566) is 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine?
The canonical SMILES for 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine is CC(C)N1Cc2[nH]nc(N)c2C1C.
What is the InChIKey of 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine?
The InChIKey is RBXYJXCDUGAYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-5(2)13-4-7-8(6(13)3)9(10)12-11-7/h5-6H,4H2,1-3H3,(H3,10,11,12).
What are the key properties of 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine?
4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine has a molecular weight of 180.25 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 83846566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).