N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide

C24H28N8OS — CID 143465132

IUPACN,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide
SMILESCc1cc(Nc2nc(C3=CCCNC3)cn3c(C4=CCN(C)N=C4)cnc23)sc1C(=O)N(C)C
InChIInChI=1S/C24H28N8OS/c1-15-10-20(34-21(15)24(33)30(2)3)29-22-23-26-13-19(17-7-9-31(4)27-12-17)32(23)14-18(28-22)16-6-5-8-25-11-16/h6-7,10,12-14,25H,5,8-9,11H2,1-4H3,(H,28,29)
InChIKeyXPEAUIJMIAOVEX-UHFFFAOYSA-N
MW476.61 g/mol
LogP3.24
Rot. Bonds5

About N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide

N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide (PubChem CID 143465132) has the molecular formula C24H28N8OS and a molecular weight of 476.61 g/mol. Its IUPAC name is N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide.

Molecular Properties

Compound NameN,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide
PubChem CID143465132
Molecular FormulaC24H28N8OS
Molecular Weight476.61 g/mol
Exact Mass476.21
IUPAC NameN,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide
SMILESCc1cc(Nc2nc(C3=CCCNC3)cn3c(C4=CCN(C)N=C4)cnc23)sc1C(=O)N(C)C
InChIInChI=1S/C24H28N8OS/c1-15-10-20(34-21(15)24(33)30(2)3)29-22-23-26-13-19(17-7-9-31(4)27-12-17)32(23)14-18(28-22)16-6-5-8-25-11-16/h6-7,10,12-14,25H,5,8-9,11H2,1-4H3,(H,28,29)
InChIKeyXPEAUIJMIAOVEX-UHFFFAOYSA-N
XLogP3.24
TPSA90.16 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.61
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide with MolForge

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Related Compounds

N-[4-methyl-5-(2-methyl-1,5-dihydropyrazol-4-yl)thiophen-2-yl]-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-amine
CID 143460462
N,3-dimethyl-5-[[3-(2-methyl-1,5-dihydropyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-sulfonamide
CID 143460912
3-methyl-5-[[3-(2-methyl-1,5-dihydropyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-N-(1-methylsulfonylpiperidin-4-yl)thiophene-2-carboxamide
CID 71197074
N-[3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]thieno[2,3-b]pyridin-2-amine
CID 58873936
2-methyl-N-[3-(2-methyl-3,4-dihydropyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]-1,3-thiazol-5-amine
CID 71195334
tert-butyl 5-[8-[[5-[(dimethylamino)methyl]-4-methylthiophen-2-yl]amino]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
CID 143460595
3-(2-methyl-1,5-dihydropyrazol-4-yl)-8-[(3-methyl-1,2-thiazol-5-yl)amino]imidazo[1,2-a]pyrazine-6-carboxamide
CID 143465275
3-(1-methylpyrazol-4-yl)-N-(3-methyl-2-pyrrolidin-1-ylsulfonyl-2,3-dihydrothiophen-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-amine
CID 89360215
N-[3,6-bis(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine;5-[[3-(5-cyanofuran-3-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-N,N-diethyl-3-methylthiophene-2-sulfonamide;3-methyl-N-[3-(2-methyl-1H-pyrazol-2-ium-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2,4-thiadiazol-5-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine;4-[8-[(3-methyl-1,2-thiazol-5-yl)amino]-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-3-yl]furan-2-carbonitrile
CID 158081584
N-(3-methyl-2-morpholin-4-ylsulfonyl-2,3-dihydrothiophen-5-yl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-amine
CID 89360135
N-[6-bromo-3-(1,6-dihydropyridazin-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
CID 143460943
tert-butyl 5-[8-[[5-(cyclopropylsulfamoyl)-4-methylthiophen-2-yl]amino]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
CID 58873884

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide?
The IUPAC name of N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide (CID 143465132) is N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide.
What is the SMILES notation for N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide?
The canonical SMILES for N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide is Cc1cc(Nc2nc(C3=CCCNC3)cn3c(C4=CCN(C)N=C4)cnc23)sc1C(=O)N(C)C.
What is the InChIKey of N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide?
The InChIKey is XPEAUIJMIAOVEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N8OS/c1-15-10-20(34-21(15)24(33)30(2)3)29-22-23-26-13-19(17-7-9-31(4)27-12-17)32(23)14-18(28-22)16-6-5-8-25-11-16/h6-7,10,12-14,25H,5,8-9,11H2,1-4H3,(H,28,29).
What are the key properties of N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide?
N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide has a molecular weight of 476.61 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-5-[[3-(2-methyl-3H-pyridazin-5-yl)-6-(1,2,3,6-tetrahydropyridin-5-yl)imidazo[1,2-a]pyrazin-8-yl]amino]thiophene-2-carboxamide is sourced from PubChem (CID 143465132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).