N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine

C13H20N4 — CID 115039096

IUPACN-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
SMILESc1c(NCCC2CCNC2)nnc2c1CCC2
InChIInChI=1S/C13H20N4/c1-2-11-8-13(17-16-12(11)3-1)15-7-5-10-4-6-14-9-10/h8,10,14H,1-7,9H2,(H,15,17)
InChIKeyHTFZSRTVCUCBMB-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.38
Rot. Bonds4

About N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine

N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine (PubChem CID 115039096) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine.

Molecular Properties

Compound NameN-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
PubChem CID115039096
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
SMILESc1c(NCCC2CCNC2)nnc2c1CCC2
InChIInChI=1S/C13H20N4/c1-2-11-8-13(17-16-12(11)3-1)15-7-5-10-4-6-14-9-10/h8,10,14H,1-7,9H2,(H,15,17)
InChIKeyHTFZSRTVCUCBMB-UHFFFAOYSA-N
XLogP1.38
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
CID 115030920
N-(2-piperidin-3-ylethyl)-6-propan-2-ylpyridazin-3-amine
CID 116972213
1-methyl-N-(2-pyrrolidin-3-ylethyl)-4,5,6,7-tetrahydrobenzimidazol-2-amine
CID 115055130
N-(cyclopentylmethyl)-5,6,7,8-tetrahydropyrido[3,4-c]pyridazin-3-amine
CID 117104569
N-(2-pyrrolidin-3-ylethyl)-6-(1H-pyrrol-3-yl)pyridazin-3-amine
CID 116972198
6-ethyl-N-(2-piperidin-3-ylethyl)pyridazin-3-amine
CID 116972209
N-(2-piperidin-3-ylethyl)-2,3-dihydro-1-benzofuran-5-amine
CID 115211290
N-(2-pyrrolidin-3-ylethyl)-1,3-benzoxazol-2-amine
CID 63623825
4-methyl-N-(2-piperidin-3-ylethyl)pyridin-2-amine
CID 63629904
2-(2-pyrrolidin-3-ylethylamino)quinoline-4-carboxamide
CID 63884282
N-(2-piperidin-4-ylethyl)-6-propylpyridazin-3-amine
CID 116972215
N-(2-pyrrolidin-3-ylethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114401742

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The IUPAC name of N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine (CID 115039096) is N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine.
What is the SMILES notation for N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The canonical SMILES for N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine is c1c(NCCC2CCNC2)nnc2c1CCC2.
What is the InChIKey of N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
The InChIKey is HTFZSRTVCUCBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-2-11-8-13(17-16-12(11)3-1)15-7-5-10-4-6-14-9-10/h8,10,14H,1-7,9H2,(H,15,17).
What are the key properties of N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine?
N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine has a molecular weight of 232.33 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-3-ylethyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine is sourced from PubChem (CID 115039096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).