N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine

C14H12FN7S — CID 143460855

IUPACN-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCc1cc(Nc2nc(F)cn3c(-c4cnn(C)c4)cnc23)sn1
InChIInChI=1S/C14H12FN7S/c1-8-3-12(23-20-8)19-13-14-16-5-10(9-4-17-21(2)6-9)22(14)7-11(15)18-13/h3-7H,1-2H3,(H,18,19)
InChIKeySLUFIVAZYPWXBD-UHFFFAOYSA-N
MW329.36 g/mol
LogP2.78
Rot. Bonds3

About N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine

N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine (PubChem CID 143460855) has the molecular formula C14H12FN7S and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
PubChem CID143460855
Molecular FormulaC14H12FN7S
Molecular Weight329.36 g/mol
Exact Mass329.09
IUPAC NameN-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCc1cc(Nc2nc(F)cn3c(-c4cnn(C)c4)cnc23)sn1
InChIInChI=1S/C14H12FN7S/c1-8-3-12(23-20-8)19-13-14-16-5-10(9-4-17-21(2)6-9)22(14)7-11(15)18-13/h3-7H,1-2H3,(H,18,19)
InChIKeySLUFIVAZYPWXBD-UHFFFAOYSA-N
XLogP2.78
TPSA72.93 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The IUPAC name of N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine (CID 143460855) is N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine.
What is the SMILES notation for N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The canonical SMILES for N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine is Cc1cc(Nc2nc(F)cn3c(-c4cnn(C)c4)cnc23)sn1.
What is the InChIKey of N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The InChIKey is SLUFIVAZYPWXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN7S/c1-8-3-12(23-20-8)19-13-14-16-5-10(9-4-17-21(2)6-9)22(14)7-11(15)18-13/h3-7H,1-2H3,(H,18,19).
What are the key properties of N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine has a molecular weight of 329.36 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine is sourced from PubChem (CID 143460855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).