3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine

C18H19N5 — CID 59519568

IUPAC3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESC1=C(c2cnc3ccc(NCc4ccccn4)nn23)CCCC1
InChIInChI=1S/C18H19N5/c1-2-6-14(7-3-1)16-13-21-18-10-9-17(22-23(16)18)20-12-15-8-4-5-11-19-15/h4-6,8-11,13H,1-3,7,12H2,(H,20,22)
InChIKeyHNEXKMNLDWMYEN-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.69
Rot. Bonds4

About 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine

3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 59519568) has the molecular formula C18H19N5 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound Name3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
PubChem CID59519568
Molecular FormulaC18H19N5
Molecular Weight305.38 g/mol
Exact Mass305.16
IUPAC Name3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESC1=C(c2cnc3ccc(NCc4ccccn4)nn23)CCCC1
InChIInChI=1S/C18H19N5/c1-2-6-14(7-3-1)16-13-21-18-10-9-17(22-23(16)18)20-12-15-8-4-5-11-19-15/h4-6,8-11,13H,1-3,7,12H2,(H,20,22)
InChIKeyHNEXKMNLDWMYEN-UHFFFAOYSA-N
XLogP3.69
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-methylphenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 143711795
3-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 58857801
3-butyl-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 70841616
3-[(E)-pent-1-enyl]-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine;hydrochloride
CID 68648391
3-(4-fluorocyclohexen-1-yl)-N-(furan-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 71212981
6-N-[2-(cyclohexen-1-yl)ethyl]-2-methyl-4-N-(pyridin-2-ylmethyl)pyrimidine-4,6-diamine
CID 112869351
3-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
CID 58857576
[2-[6-[(4-fluorophenyl)methylamino]imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol
CID 126475803
4-[6-(benzylamino)imidazo[1,2-b]pyridazin-3-yl]benzonitrile
CID 122179540
3-[3-(aminomethyl)phenyl]-N-[(4-fluorophenyl)methyl]imidazo[1,2-b]pyridazin-6-amine
CID 126475815
[4-[6-(thiophen-2-ylmethylamino)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol
CID 58857573
2-methyl-N-(pyridin-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-amine
CID 50800618

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine (CID 59519568) is 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine is C1=C(c2cnc3ccc(NCc4ccccn4)nn23)CCCC1.
What is the InChIKey of 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine?
The InChIKey is HNEXKMNLDWMYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5/c1-2-6-14(7-3-1)16-13-21-18-10-9-17(22-23(16)18)20-12-15-8-4-5-11-19-15/h4-6,8-11,13H,1-3,7,12H2,(H,20,22).
What are the key properties of 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine?
3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 305.38 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexen-1-yl)-N-(pyridin-2-ylmethyl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 59519568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).