N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine

C14H14N4S — CID 6419790

IUPACN-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine
SMILESc1csc(-c2cnc3ccc(NCC4CC4)nn23)c1
InChIInChI=1S/C14H14N4S/c1-2-12(19-7-1)11-9-16-14-6-5-13(17-18(11)14)15-8-10-3-4-10/h1-2,5-7,9-10H,3-4,8H2,(H,15,17)
InChIKeyMNKKMNSSSZDJOR-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.28
Rot. Bonds4

About N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine

N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine (PubChem CID 6419790) has the molecular formula C14H14N4S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine
PubChem CID6419790
Molecular FormulaC14H14N4S
Molecular Weight270.36 g/mol
Exact Mass270.09
IUPAC NameN-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine
SMILESc1csc(-c2cnc3ccc(NCC4CC4)nn23)c1
InChIInChI=1S/C14H14N4S/c1-2-12(19-7-1)11-9-16-14-6-5-13(17-18(11)14)15-8-10-3-4-10/h1-2,5-7,9-10H,3-4,8H2,(H,15,17)
InChIKeyMNKKMNSSSZDJOR-UHFFFAOYSA-N
XLogP3.28
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine (CID 6419790) is N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine is c1csc(-c2cnc3ccc(NCC4CC4)nn23)c1.
What is the InChIKey of N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine?
The InChIKey is MNKKMNSSSZDJOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4S/c1-2-12(19-7-1)11-9-16-14-6-5-13(17-18(11)14)15-8-10-3-4-10/h1-2,5-7,9-10H,3-4,8H2,(H,15,17).
What are the key properties of N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine?
N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine has a molecular weight of 270.36 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-thiophen-2-ylimidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 6419790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).