1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine

C11H17N3O — CID 105460780

IUPAC1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine
SMILESNc1nn(C2CCCCC2)c2c1COC2
InChIInChI=1S/C11H17N3O/c12-11-9-6-15-7-10(9)14(13-11)8-4-2-1-3-5-8/h8H,1-7H2,(H2,12,13)
InChIKeyFXECQUHDQXRUSK-UHFFFAOYSA-N
MW207.28 g/mol
LogP2.00
Rot. Bonds1

About 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine

1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine (PubChem CID 105460780) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine
PubChem CID105460780
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine
SMILESNc1nn(C2CCCCC2)c2c1COC2
InChIInChI=1S/C11H17N3O/c12-11-9-6-15-7-10(9)14(13-11)8-4-2-1-3-5-8/h8H,1-7H2,(H2,12,13)
InChIKeyFXECQUHDQXRUSK-UHFFFAOYSA-N
XLogP2.00
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine?
The IUPAC name of 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine (CID 105460780) is 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine.
What is the SMILES notation for 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine?
The canonical SMILES for 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine is Nc1nn(C2CCCCC2)c2c1COC2.
What is the InChIKey of 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine?
The InChIKey is FXECQUHDQXRUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-11-9-6-15-7-10(9)14(13-11)8-4-2-1-3-5-8/h8H,1-7H2,(H2,12,13).
What are the key properties of 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine?
1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine has a molecular weight of 207.28 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4,6-dihydrofuro[3,4-d]pyrazol-3-amine is sourced from PubChem (CID 105460780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).