N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide

C21H21N7O3 — CID 136942070

IUPACN'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide
SMILESN/C(=N\O)c1cnc(N2CCOCC2)c2nc(COc3ccc4ccccc4n3)cn12
InChIInChI=1S/C21H21N7O3/c22-19(26-29)17-11-23-20(27-7-9-30-10-8-27)21-24-15(12-28(17)21)13-31-18-6-5-14-3-1-2-4-16(14)25-18/h1-6,11-12,29H,7-10,13H2,(H2,22,26)
InChIKeyGFOISQPFBVESFP-UHFFFAOYSA-N
MW419.45 g/mol
LogP1.79
Rot. Bonds5

About N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide

N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide (PubChem CID 136942070) has the molecular formula C21H21N7O3 and a molecular weight of 419.45 g/mol. Its IUPAC name is N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide
PubChem CID136942070
Molecular FormulaC21H21N7O3
Molecular Weight419.45 g/mol
Exact Mass419.17
IUPAC NameN'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide
SMILESN/C(=N\O)c1cnc(N2CCOCC2)c2nc(COc3ccc4ccccc4n3)cn12
InChIInChI=1S/C21H21N7O3/c22-19(26-29)17-11-23-20(27-7-9-30-10-8-27)21-24-15(12-28(17)21)13-31-18-6-5-14-3-1-2-4-16(14)25-18/h1-6,11-12,29H,7-10,13H2,(H2,22,26)
InChIKeyGFOISQPFBVESFP-UHFFFAOYSA-N
XLogP1.79
TPSA123.39 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.45
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide
CID 137209345
4-[8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-5-yl]piperidine-1-sulfonamide;2,2,2-trifluoroacetic acid
CID 86345569
5-[8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-5-yl]pyridine-2-sulfonamide;2,2,2-trifluoroacetic acid
CID 86345643
2-[4-[8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-5-yl]piperidin-1-yl]acetic acid;2,2,2-trifluoroacetic acid
CID 86345571
tert-butyl 4-[5-[8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-5-yl]-2-pyridinyl]piperazine-1-carboxylate
CID 86345944
[[amino-[5-[8-morpholin-4-yl-2-(2-quinolin-2-ylethenyl)imidazo[1,2-a]pyrazin-5-yl]-2-pyridinyl]methylidene]amino] ethyl carbonate
CID 123657151
N-[8-morpholin-4-yl-2-(2-quinolin-2-ylethyl)imidazo[1,2-a]pyrazin-5-yl]sulfonylacetamide
CID 86345857
2-[4-[8-morpholin-4-yl-2-(2-quinolin-2-ylethyl)imidazo[1,2-a]pyrazin-5-yl]phenyl]-1H-1,2,4-triazol-5-one
CID 86346032
6-[8-morpholin-4-yl-2-(2-quinolin-2-ylethyl)imidazo[1,2-a]pyrazin-5-yl]-3H-1,3-benzoxazol-2-one
CID 86345647
4-[5-(6-piperazin-1-yl-3-pyridinyl)-2-(2-quinolin-2-ylethenyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 123392808
4-[2-(2-quinolin-2-ylethenyl)-5-[6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 123632757
3-morpholin-4-ylquinolin-2-amine
CID 67346064

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide?
The IUPAC name of N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide (CID 136942070) is N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide.
What is the SMILES notation for N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide?
The canonical SMILES for N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide is N/C(=N\O)c1cnc(N2CCOCC2)c2nc(COc3ccc4ccccc4n3)cn12.
What is the InChIKey of N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide?
The InChIKey is GFOISQPFBVESFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N7O3/c22-19(26-29)17-11-23-20(27-7-9-30-10-8-27)21-24-15(12-28(17)21)13-31-18-6-5-14-3-1-2-4-16(14)25-18/h1-6,11-12,29H,7-10,13H2,(H2,22,26).
What are the key properties of N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide?
N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide has a molecular weight of 419.45 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazine-5-carboximidamide is sourced from PubChem (CID 136942070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).