6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine

C12H19N5 — CID 79304996

IUPAC6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCn1nc(C)c2nc(N)n(C3CCCC3)c21
InChIInChI=1S/C12H19N5/c1-3-16-11-10(8(2)15-16)14-12(13)17(11)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H2,13,14)
InChIKeyHSQPTIWQPFUNEW-UHFFFAOYSA-N
MW233.32 g/mol
LogP2.26
Rot. Bonds2

About 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine

6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine (PubChem CID 79304996) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine.

Molecular Properties

Compound Name6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine
PubChem CID79304996
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCn1nc(C)c2nc(N)n(C3CCCC3)c21
InChIInChI=1S/C12H19N5/c1-3-16-11-10(8(2)15-16)14-12(13)17(11)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H2,13,14)
InChIKeyHSQPTIWQPFUNEW-UHFFFAOYSA-N
XLogP2.26
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine?
The IUPAC name of 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine (CID 79304996) is 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine.
What is the SMILES notation for 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine?
The canonical SMILES for 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine is CCn1nc(C)c2nc(N)n(C3CCCC3)c21.
What is the InChIKey of 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine?
The InChIKey is HSQPTIWQPFUNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-3-16-11-10(8(2)15-16)14-12(13)17(11)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H2,13,14).
What are the key properties of 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine?
6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine has a molecular weight of 233.32 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-1-ethyl-3-methylimidazo[4,5-d]pyrazol-5-amine is sourced from PubChem (CID 79304996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).