N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine

C25H24N6O — CID 155563378

IUPACN,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine
SMILESCN(C)CCCOc1ccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)cn1
InChIInChI=1S/C25H24N6O/c1-30(2)11-4-12-32-25-9-7-20(14-29-25)22-17-31-23(15-28-24(31)16-27-22)19-6-8-21-18(13-19)5-3-10-26-21/h3,5-10,13-17H,4,11-12H2,1-2H3
InChIKeyNJILHSJCGQQAOW-UHFFFAOYSA-N
MW424.51 g/mol
LogP4.34
Rot. Bonds7

About N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine

N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine (PubChem CID 155563378) has the molecular formula C25H24N6O and a molecular weight of 424.51 g/mol. Its IUPAC name is N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine
PubChem CID155563378
Molecular FormulaC25H24N6O
Molecular Weight424.51 g/mol
Exact Mass424.20
IUPAC NameN,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine
SMILESCN(C)CCCOc1ccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)cn1
InChIInChI=1S/C25H24N6O/c1-30(2)11-4-12-32-25-9-7-20(14-29-25)22-17-31-23(15-28-24(31)16-27-22)19-6-8-21-18(13-19)5-3-10-26-21/h3,5-10,13-17H,4,11-12H2,1-2H3
InChIKeyNJILHSJCGQQAOW-UHFFFAOYSA-N
XLogP4.34
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.51
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine?
The IUPAC name of N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine (CID 155563378) is N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine is CN(C)CCCOc1ccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)cn1.
What is the InChIKey of N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine?
The InChIKey is NJILHSJCGQQAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O/c1-30(2)11-4-12-32-25-9-7-20(14-29-25)22-17-31-23(15-28-24(31)16-27-22)19-6-8-21-18(13-19)5-3-10-26-21/h3,5-10,13-17H,4,11-12H2,1-2H3.
What are the key properties of N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine?
N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine has a molecular weight of 424.51 g/mol, XLogP of 4.34, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[[5-(3-quinolin-6-ylimidazo[1,2-a]pyrazin-6-yl)-2-pyridinyl]oxy]propan-1-amine is sourced from PubChem (CID 155563378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).