3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine

C19H20N8O — CID 11667954

IUPAC3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1
InChIInChI=1S/C19H20N8O/c1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15/h2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25)/t15-/m1/s1
InChIKeyZVNFLTYEQVTKCD-OAHLLOKOSA-N
MW376.42 g/mol
LogP2.01
Rot. Bonds5

About 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine

3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 11667954) has the molecular formula C19H20N8O and a molecular weight of 376.42 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID11667954
Molecular FormulaC19H20N8O
Molecular Weight376.42 g/mol
Exact Mass376.18
IUPAC Name3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1
InChIInChI=1S/C19H20N8O/c1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15/h2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25)/t15-/m1/s1
InChIKeyZVNFLTYEQVTKCD-OAHLLOKOSA-N
XLogP2.01
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine (CID 11667954) is 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine is Cn1cc(-c2cnc3c(Nc4ccnc(O[C@@H]5CCNC5)c4)nccn23)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is ZVNFLTYEQVTKCD-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H20N8O/c1-26-12-13(9-24-26)16-11-23-19-18(22-6-7-27(16)19)25-14-2-5-21-17(8-14)28-15-3-4-20-10-15/h2,5-9,11-12,15,20H,3-4,10H2,1H3,(H,21,22,25)/t15-/m1/s1.
What are the key properties of 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine?
3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 376.42 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-N-[2-[(3R)-pyrrolidin-3-yl]oxy-4-pyridinyl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 11667954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).