1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine

C15H26N6 — CID 79274716

IUPAC1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine
SMILESCc1nn(C)c2c1nc(N)n2CCCN1CCCCC1C
InChIInChI=1S/C15H26N6/c1-11-7-4-5-8-20(11)9-6-10-21-14-13(17-15(21)16)12(2)18-19(14)3/h11H,4-10H2,1-3H3,(H2,16,17)
InChIKeyZDMBVRKGMDWZTK-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.92
Rot. Bonds4

About 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine

1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine (PubChem CID 79274716) has the molecular formula C15H26N6 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine.

Molecular Properties

Compound Name1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine
PubChem CID79274716
Molecular FormulaC15H26N6
Molecular Weight290.41 g/mol
Exact Mass290.22
IUPAC Name1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine
SMILESCc1nn(C)c2c1nc(N)n2CCCN1CCCCC1C
InChIInChI=1S/C15H26N6/c1-11-7-4-5-8-20(11)9-6-10-21-14-13(17-15(21)16)12(2)18-19(14)3/h11H,4-10H2,1-3H3,(H2,16,17)
InChIKeyZDMBVRKGMDWZTK-UHFFFAOYSA-N
XLogP1.92
TPSA64.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine?
The IUPAC name of 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine (CID 79274716) is 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine.
What is the SMILES notation for 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine?
The canonical SMILES for 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine is Cc1nn(C)c2c1nc(N)n2CCCN1CCCCC1C.
What is the InChIKey of 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine?
The InChIKey is ZDMBVRKGMDWZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6/c1-11-7-4-5-8-20(11)9-6-10-21-14-13(17-15(21)16)12(2)18-19(14)3/h11H,4-10H2,1-3H3,(H2,16,17).
What are the key properties of 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine?
1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine has a molecular weight of 290.41 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-[3-(2-methylpiperidin-1-yl)propyl]imidazo[4,5-d]pyrazol-5-amine is sourced from PubChem (CID 79274716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).