3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine

C15H14ClN5O — CID 177159305

IUPAC3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine
SMILESCOc1cc2ncc(-c3ccc(Cl)c(N)n3)n2nc1C1CC1
InChIInChI=1S/C15H14ClN5O/c1-22-12-6-13-18-7-11(10-5-4-9(16)15(17)19-10)21(13)20-14(12)8-2-3-8/h4-8H,2-3H2,1H3,(H2,17,19)
InChIKeyNXTZWDBYIGLFOV-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.91
Rot. Bonds3

About 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine

3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine (PubChem CID 177159305) has the molecular formula C15H14ClN5O and a molecular weight of 315.76 g/mol. Its IUPAC name is 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine
PubChem CID177159305
Molecular FormulaC15H14ClN5O
Molecular Weight315.76 g/mol
Exact Mass315.09
IUPAC Name3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine
SMILESCOc1cc2ncc(-c3ccc(Cl)c(N)n3)n2nc1C1CC1
InChIInChI=1S/C15H14ClN5O/c1-22-12-6-13-18-7-11(10-5-4-9(16)15(17)19-10)21(13)20-14(12)8-2-3-8/h4-8H,2-3H2,1H3,(H2,17,19)
InChIKeyNXTZWDBYIGLFOV-UHFFFAOYSA-N
XLogP2.91
TPSA78.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-3-methoxypyridin-2-amine
CID 170631104
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-4-fluoropyridin-2-amine
CID 164537189
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-5-fluoropyridin-2-amine
CID 170631232
5-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-[(3R)-piperidin-3-yl]pyridin-2-amine
CID 177159396
4-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 167449964
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-(4-fluoropiperidin-3-yl)-3-methoxypyridin-2-amine
CID 170631276
5-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-(4-fluoropiperidin-3-yl)pyridin-2-amine
CID 177159461
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-4-methylpyridin-2-amine
CID 170630919
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-3,5-difluoropyridin-2-amine;3-fluoropiperidine
CID 177159256
[2-amino-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-5-fluoro-3-pyridinyl]methanol;ethane;piperidine
CID 177159236
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-(4-fluoropiperidin-3-yl)-4-methylpyridin-2-amine
CID 174291202
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
CID 167450105

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine?
The IUPAC name of 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine (CID 177159305) is 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine.
What is the SMILES notation for 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine?
The canonical SMILES for 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine is COc1cc2ncc(-c3ccc(Cl)c(N)n3)n2nc1C1CC1.
What is the InChIKey of 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine?
The InChIKey is NXTZWDBYIGLFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN5O/c1-22-12-6-13-18-7-11(10-5-4-9(16)15(17)19-10)21(13)20-14(12)8-2-3-8/h4-8H,2-3H2,1H3,(H2,17,19).
What are the key properties of 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine?
3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine has a molecular weight of 315.76 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)pyridin-2-amine is sourced from PubChem (CID 177159305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).