N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine

C15H25N5 — CID 58227329

IUPACN-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine
SMILESCN1CCN(c2cnnc(NCC3CCCC3)c2)CC1
InChIInChI=1S/C15H25N5/c1-19-6-8-20(9-7-19)14-10-15(18-17-12-14)16-11-13-4-2-3-5-13/h10,12-13H,2-9,11H2,1H3,(H,16,18)
InChIKeyFOGWEVHEURTTGH-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.83
Rot. Bonds4

About N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine

N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine (PubChem CID 58227329) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine
PubChem CID58227329
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine
SMILESCN1CCN(c2cnnc(NCC3CCCC3)c2)CC1
InChIInChI=1S/C15H25N5/c1-19-6-8-20(9-7-19)14-10-15(18-17-12-14)16-11-13-4-2-3-5-13/h10,12-13H,2-9,11H2,1H3,(H,16,18)
InChIKeyFOGWEVHEURTTGH-UHFFFAOYSA-N
XLogP1.83
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The IUPAC name of N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine (CID 58227329) is N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The canonical SMILES for N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine is CN1CCN(c2cnnc(NCC3CCCC3)c2)CC1.
What is the InChIKey of N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine?
The InChIKey is FOGWEVHEURTTGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-19-6-8-20(9-7-19)14-10-15(18-17-12-14)16-11-13-4-2-3-5-13/h10,12-13H,2-9,11H2,1H3,(H,16,18).
What are the key properties of N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine?
N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine has a molecular weight of 275.40 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-5-(4-methylpiperazin-1-yl)pyridazin-3-amine is sourced from PubChem (CID 58227329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).