6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine

C19H21F2N7 — CID 164561142

IUPAC6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
SMILESFC1(F)CCN(c2cn3c(-c4cccc(NC5CCNC5)n4)cnc3cn2)C1
InChIInChI=1S/C19H21F2N7/c20-19(21)5-7-27(12-19)18-11-28-15(9-23-17(28)10-24-18)14-2-1-3-16(26-14)25-13-4-6-22-8-13/h1-3,9-11,13,22H,4-8,12H2,(H,25,26)
InChIKeyUVTUIGSJZVGVNM-UHFFFAOYSA-N
MW385.42 g/mol
LogP2.41
Rot. Bonds4

About 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine

6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 164561142) has the molecular formula C19H21F2N7 and a molecular weight of 385.42 g/mol. Its IUPAC name is 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID164561142
Molecular FormulaC19H21F2N7
Molecular Weight385.42 g/mol
Exact Mass385.18
IUPAC Name6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
SMILESFC1(F)CCN(c2cn3c(-c4cccc(NC5CCNC5)n4)cnc3cn2)C1
InChIInChI=1S/C19H21F2N7/c20-19(21)5-7-27(12-19)18-11-28-15(9-23-17(28)10-24-18)14-2-1-3-16(26-14)25-13-4-6-22-8-13/h1-3,9-11,13,22H,4-8,12H2,(H,25,26)
InChIKeyUVTUIGSJZVGVNM-UHFFFAOYSA-N
XLogP2.41
TPSA70.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine (CID 164561142) is 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine is FC1(F)CCN(c2cn3c(-c4cccc(NC5CCNC5)n4)cnc3cn2)C1.
What is the InChIKey of 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is UVTUIGSJZVGVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2N7/c20-19(21)5-7-27(12-19)18-11-28-15(9-23-17(28)10-24-18)14-2-1-3-16(26-14)25-13-4-6-22-8-13/h1-3,9-11,13,22H,4-8,12H2,(H,25,26).
What are the key properties of 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine?
6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 385.42 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 164561142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).