N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine

C12H18N4 — CID 115030920

IUPACN-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
SMILESc1c(NC2CCCNC2)nnc2c1CCC2
InChIInChI=1S/C12H18N4/c1-3-9-7-12(16-15-11(9)5-1)14-10-4-2-6-13-8-10/h7,10,13H,1-6,8H2,(H,14,16)
InChIKeySWPDBEVQJDDIMB-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.13
Rot. Bonds2

About N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine

N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine (PubChem CID 115030920) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine.

Molecular Properties

Compound NameN-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
PubChem CID115030920
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC NameN-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
SMILESc1c(NC2CCCNC2)nnc2c1CCC2
InChIInChI=1S/C12H18N4/c1-3-9-7-12(16-15-11(9)5-1)14-10-4-2-6-13-8-10/h7,10,13H,1-6,8H2,(H,14,16)
InChIKeySWPDBEVQJDDIMB-UHFFFAOYSA-N
XLogP1.13
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The IUPAC name of N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine (CID 115030920) is N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine.
What is the SMILES notation for N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The canonical SMILES for N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine is c1c(NC2CCCNC2)nnc2c1CCC2.
What is the InChIKey of N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The InChIKey is SWPDBEVQJDDIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-3-9-7-12(16-15-11(9)5-1)14-10-4-2-6-13-8-10/h7,10,13H,1-6,8H2,(H,14,16).
What are the key properties of N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine has a molecular weight of 218.30 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine is sourced from PubChem (CID 115030920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).