N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine

C17H13FN4S — CID 126475158

IUPACN-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine
SMILESFc1ccc(CNc2nccn3c(-c4ccsc4)cnc23)cc1
InChIInChI=1S/C17H13FN4S/c18-14-3-1-12(2-4-14)9-20-16-17-21-10-15(13-5-8-23-11-13)22(17)7-6-19-16/h1-8,10-11H,9H2,(H,19,20)
InChIKeyALKONOLBUOELIH-UHFFFAOYSA-N
MW324.38 g/mol
LogP4.21
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine

N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 126475158) has the molecular formula C17H13FN4S and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine
PubChem CID126475158
Molecular FormulaC17H13FN4S
Molecular Weight324.38 g/mol
Exact Mass324.08
IUPAC NameN-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine
SMILESFc1ccc(CNc2nccn3c(-c4ccsc4)cnc23)cc1
InChIInChI=1S/C17H13FN4S/c18-14-3-1-12(2-4-14)9-20-16-17-21-10-15(13-5-8-23-11-13)22(17)7-6-19-16/h1-8,10-11H,9H2,(H,19,20)
InChIKeyALKONOLBUOELIH-UHFFFAOYSA-N
XLogP4.21
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-fluorophenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 126472520
N-(4-chlorophenyl)-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine
CID 126474756
3-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
CID 46241678
4-[(3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
CID 126472088
4-[[[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzaldehyde;methanol
CID 143766220
5-[[[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]pyridine-2-sulfonamide
CID 135998296
4-[[[3-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide
CID 25207627
3-(1H-pyrazol-4-yl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
CID 58873894
5-[[[3-(3,5-difluorophenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]-2-(2-methyl-4-pyridinyl)pyridin-3-ol
CID 155478922
N-(pyridin-4-ylmethyl)-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 126472930
8-piperazin-1-yl-5-thiophen-3-ylimidazo[1,2-a]pyrazine
CID 58446975
3-[8-[(3,4-dichlorophenyl)methylamino]imidazo[1,2-a]pyrazin-5-yl]phenol
CID 126472154

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine (CID 126475158) is N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine is Fc1ccc(CNc2nccn3c(-c4ccsc4)cnc23)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is ALKONOLBUOELIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN4S/c18-14-3-1-12(2-4-14)9-20-16-17-21-10-15(13-5-8-23-11-13)22(17)7-6-19-16/h1-8,10-11H,9H2,(H,19,20).
What are the key properties of N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine?
N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 324.38 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 126475158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).