2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine

C11H14N4 — CID 90167449

IUPAC2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine
SMILESNc1c2c(nn1C1=CN=CCC1)CCC2
InChIInChI=1S/C11H14N4/c12-11-9-4-1-5-10(9)14-15(11)8-3-2-6-13-7-8/h6-7H,1-5,12H2
InChIKeyMRNCOEYNQTVUIV-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.62
Rot. Bonds1

About 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine

2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine (PubChem CID 90167449) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine.

Molecular Properties

Compound Name2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine
PubChem CID90167449
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine
SMILESNc1c2c(nn1C1=CN=CCC1)CCC2
InChIInChI=1S/C11H14N4/c12-11-9-4-1-5-10(9)14-15(11)8-3-2-6-13-7-8/h6-7H,1-5,12H2
InChIKeyMRNCOEYNQTVUIV-UHFFFAOYSA-N
XLogP1.62
TPSA56.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine?
The IUPAC name of 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine (CID 90167449) is 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine.
What is the SMILES notation for 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine?
The canonical SMILES for 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine is Nc1c2c(nn1C1=CN=CCC1)CCC2.
What is the InChIKey of 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine?
The InChIKey is MRNCOEYNQTVUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c12-11-9-4-1-5-10(9)14-15(11)8-3-2-6-13-7-8/h6-7H,1-5,12H2.
What are the key properties of 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine?
2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine has a molecular weight of 202.26 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydropyridin-5-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine is sourced from PubChem (CID 90167449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).