N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine

C15H25N5 — CID 62888182

IUPACN-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine
SMILESCN(C)CC1CCCN1c1ccc(CNC2CC2)nn1
InChIInChI=1S/C15H25N5/c1-19(2)11-14-4-3-9-20(14)15-8-7-13(17-18-15)10-16-12-5-6-12/h7-8,12,14,16H,3-6,9-11H2,1-2H3
InChIKeyPEIUYMMNJHTKQJ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.26
Rot. Bonds6

About N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine

N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine (PubChem CID 62888182) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine
PubChem CID62888182
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine
SMILESCN(C)CC1CCCN1c1ccc(CNC2CC2)nn1
InChIInChI=1S/C15H25N5/c1-19(2)11-14-4-3-9-20(14)15-8-7-13(17-18-15)10-16-12-5-6-12/h7-8,12,14,16H,3-6,9-11H2,1-2H3
InChIKeyPEIUYMMNJHTKQJ-UHFFFAOYSA-N
XLogP1.26
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine (CID 62888182) is N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine is CN(C)CC1CCCN1c1ccc(CNC2CC2)nn1.
What is the InChIKey of N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine?
The InChIKey is PEIUYMMNJHTKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-19(2)11-14-4-3-9-20(14)15-8-7-13(17-18-15)10-16-12-5-6-12/h7-8,12,14,16H,3-6,9-11H2,1-2H3.
What are the key properties of N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine?
N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine has a molecular weight of 275.40 g/mol, XLogP of 1.26, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]pyridazin-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62888182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).