N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine

C23H24N8O2S — CID 46871229

IUPACN-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1cnc(N2CC=C(c3cnc4c(Nc5ccc(S(C)(=O)=O)nc5C)nccn34)CC2)nc1
InChIInChI=1S/C23H24N8O2S/c1-15-12-26-23(27-13-15)30-9-6-17(7-10-30)19-14-25-22-21(24-8-11-31(19)22)29-18-4-5-20(28-16(18)2)34(3,32)33/h4-6,8,11-14H,7,9-10H2,1-3H3,(H,24,29)
InChIKeyPSCSYTLHKWPJRT-UHFFFAOYSA-N
MW476.57 g/mol
LogP2.97
Rot. Bonds5

About N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine

N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 46871229) has the molecular formula C23H24N8O2S and a molecular weight of 476.57 g/mol. Its IUPAC name is N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID46871229
Molecular FormulaC23H24N8O2S
Molecular Weight476.57 g/mol
Exact Mass476.17
IUPAC NameN-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1cnc(N2CC=C(c3cnc4c(Nc5ccc(S(C)(=O)=O)nc5C)nccn34)CC2)nc1
InChIInChI=1S/C23H24N8O2S/c1-15-12-26-23(27-13-15)30-9-6-17(7-10-30)19-14-25-22-21(24-8-11-31(19)22)29-18-4-5-20(28-16(18)2)34(3,32)33/h4-6,8,11-14H,7,9-10H2,1-3H3,(H,24,29)
InChIKeyPSCSYTLHKWPJRT-UHFFFAOYSA-N
XLogP2.97
TPSA118.27 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.57
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine (CID 46871229) is N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine is Cc1cnc(N2CC=C(c3cnc4c(Nc5ccc(S(C)(=O)=O)nc5C)nccn34)CC2)nc1.
What is the InChIKey of N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is PSCSYTLHKWPJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N8O2S/c1-15-12-26-23(27-13-15)30-9-6-17(7-10-30)19-14-25-22-21(24-8-11-31(19)22)29-18-4-5-20(28-16(18)2)34(3,32)33/h4-6,8,11-14H,7,9-10H2,1-3H3,(H,24,29).
What are the key properties of N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine?
N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 476.57 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-methylsulfonyl-3-pyridinyl)-3-[1-(5-methylpyrimidin-2-yl)-3,6-dihydro-2H-pyridin-4-yl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 46871229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).