6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane

C20H27N7O — CID 167450105

IUPAC6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
SMILESCC.COc1cc2ncc(-c3cncc(NC4CCNC4)n3)n2nc1C1CC1
InChIInChI=1S/C18H21N7O.C2H6/c1-26-15-6-17-21-9-14(25(17)24-18(15)11-2-3-11)13-8-20-10-16(23-13)22-12-4-5-19-7-12;1-2/h6,8-12,19H,2-5,7H2,1H3,(H,22,23);1-2H3
InChIKeyAIBWDBKOKUDJCS-UHFFFAOYSA-N
MW381.48 g/mol
LogP2.87
Rot. Bonds5

About 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane

6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane (PubChem CID 167450105) has the molecular formula C20H27N7O and a molecular weight of 381.48 g/mol. Its IUPAC name is 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane.

Molecular Properties

Compound Name6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
PubChem CID167450105
Molecular FormulaC20H27N7O
Molecular Weight381.48 g/mol
Exact Mass381.23
IUPAC Name6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
SMILESCC.COc1cc2ncc(-c3cncc(NC4CCNC4)n3)n2nc1C1CC1
InChIInChI=1S/C18H21N7O.C2H6/c1-26-15-6-17-21-9-14(25(17)24-18(15)11-2-3-11)13-8-20-10-16(23-13)22-12-4-5-19-7-12;1-2/h6,8-12,19H,2-5,7H2,1H3,(H,22,23);1-2H3
InChIKeyAIBWDBKOKUDJCS-UHFFFAOYSA-N
XLogP2.87
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-4-phenoxy-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 170631209
1,1,1-trifluoro-2-[7-methoxy-3-[6-[[(3R)-pyrrolidin-3-yl]amino]pyrazin-2-yl]imidazo[1,2-b]pyridazin-6-yl]propan-2-ol
CID 170591578
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)-4-methylpyridin-2-amine
CID 174291202
5-chloro-6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-[(3R)-piperidin-3-yl]pyridin-2-amine
CID 177159396
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)-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)-3-methoxypyridin-2-amine
CID 170631104
ethane;1,1,1-trifluoro-2-[3-[6-[[(3R)-pyrrolidin-3-yl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 170591524
ethane;1,1,1-trifluoro-2-[3-[6-(pyrrolidin-3-ylamino)pyrazin-2-yl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 167450098
6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
CID 167450064

Frequently Asked Questions

What is the IUPAC name of 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The IUPAC name of 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane (CID 167450105) is 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane.
What is the SMILES notation for 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The canonical SMILES for 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane is CC.COc1cc2ncc(-c3cncc(NC4CCNC4)n3)n2nc1C1CC1.
What is the InChIKey of 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The InChIKey is AIBWDBKOKUDJCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O.C2H6/c1-26-15-6-17-21-9-14(25(17)24-18(15)11-2-3-11)13-8-20-10-16(23-13)22-12-4-5-19-7-12;1-2/h6,8-12,19H,2-5,7H2,1H3,(H,22,23);1-2H3.
What are the key properties of 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane has a molecular weight of 381.48 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane is sourced from PubChem (CID 167450105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).