6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane

C18H22F2N6O — CID 167450064

IUPAC6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
SMILESCC.FC(F)Oc1ccn2c(-c3cncc(NC4CCNC4)n3)cnc2c1
InChIInChI=1S/C16H16F2N6O.C2H6/c17-16(18)25-11-2-4-24-13(8-21-15(24)5-11)12-7-20-9-14(23-12)22-10-1-3-19-6-10;1-2/h2,4-5,7-10,16,19H,1,3,6H2,(H,22,23);1-2H3
InChIKeyRADGMJBUBPETPY-UHFFFAOYSA-N
MW376.41 g/mol
LogP3.19
Rot. Bonds5

About 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane

6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane (PubChem CID 167450064) has the molecular formula C18H22F2N6O and a molecular weight of 376.41 g/mol. Its IUPAC name is 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane.

Molecular Properties

Compound Name6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
PubChem CID167450064
Molecular FormulaC18H22F2N6O
Molecular Weight376.41 g/mol
Exact Mass376.18
IUPAC Name6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
SMILESCC.FC(F)Oc1ccn2c(-c3cncc(NC4CCNC4)n3)cnc2c1
InChIInChI=1S/C16H16F2N6O.C2H6/c17-16(18)25-11-2-4-24-13(8-21-15(24)5-11)12-7-20-9-14(23-12)22-10-1-3-19-6-10;1-2/h2,4-5,7-10,16,19H,1,3,6H2,(H,22,23);1-2H3
InChIKeyRADGMJBUBPETPY-UHFFFAOYSA-N
XLogP3.19
TPSA76.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

(2S)-2-[3-[6-[[(3R)-pyrrolidin-3-yl]amino]pyrazin-2-yl]imidazo[1,2-a]pyridin-7-yl]oxypropan-1-ol
CID 58303369
N-[(3S,4S)-4-fluoropiperidin-3-yl]-6-(7-propan-2-yloxyimidazo[1,2-a]pyridin-3-yl)pyrazin-2-amine
CID 166962137
6-[7-(3,3-dimethylbutoxy)imidazo[1,2-a]pyridin-3-yl]-N-[(3R)-piperidin-3-yl]pyrazin-2-amine
CID 58303406
6-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrazin-2-amine
CID 58303229
6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-[(3S,4S)-4-fluoropiperidin-3-yl]pyridin-2-amine
CID 166961592
5-fluoro-6-(7-propan-2-yloxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
CID 169129906
N-pyrrolidin-3-yl-6-[7-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
CID 166961993
N-cyclohexyl-6-(7-methylimidazo[1,2-a]pyridin-3-yl)pyrazin-2-amine
CID 58303580
6-(7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-(4-phenylpyrrolidin-3-yl)pyrazin-2-amine
CID 76753363
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyrazin-2-amine;ethane
CID 167450105
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

Frequently Asked Questions

What is the IUPAC name of 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The IUPAC name of 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane (CID 167450064) is 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane.
What is the SMILES notation for 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The canonical SMILES for 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane is CC.FC(F)Oc1ccn2c(-c3cncc(NC4CCNC4)n3)cnc2c1.
What is the InChIKey of 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
The InChIKey is RADGMJBUBPETPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N6O.C2H6/c17-16(18)25-11-2-4-24-13(8-21-15(24)5-11)12-7-20-9-14(23-12)22-10-1-3-19-6-10;1-2/h2,4-5,7-10,16,19H,1,3,6H2,(H,22,23);1-2H3.
What are the key properties of 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane?
6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane has a molecular weight of 376.41 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-pyrrolidin-3-ylpyrazin-2-amine;ethane is sourced from PubChem (CID 167450064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).