4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine

C10H16N4O2S — CID 55150345

IUPAC4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine
SMILESNC1CS(=O)(=O)CC1N1CCn2ccnc2C1
InChIInChI=1S/C10H16N4O2S/c11-8-6-17(15,16)7-9(8)14-4-3-13-2-1-12-10(13)5-14/h1-2,8-9H,3-7,11H2
InChIKeyIOGSKCJHSJOLAG-UHFFFAOYSA-N
MW256.33 g/mol
LogP-1.18
Rot. Bonds1

About 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine

4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine (PubChem CID 55150345) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine.

Molecular Properties

Compound Name4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine
PubChem CID55150345
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine
SMILESNC1CS(=O)(=O)CC1N1CCn2ccnc2C1
InChIInChI=1S/C10H16N4O2S/c11-8-6-17(15,16)7-9(8)14-4-3-13-2-1-12-10(13)5-14/h1-2,8-9H,3-7,11H2
InChIKeyIOGSKCJHSJOLAG-UHFFFAOYSA-N
XLogP-1.18
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 5-1.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine with MolForge

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Related Compounds

1-[(1-Ethylimidazol-2-yl)methyl]-2-methyl-4-(3-methylsulfonylpropyl)piperazine
CID 56802168
(4aR*,7aS*)-1-(cyclopropylmethyl)-4-(1H-imidazol-2-ylmethyl)octahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70708422
(4aR*,7aS*)-1-(cyclopropylmethyl)-4-[(1-methyl-1H-imidazol-2-yl)methyl]octahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70771745
(4aR*,7aS*)-1-(3-methyl-2-buten-1-yl)-4-[(1-methyl-1H-imidazol-2-yl)methyl]octahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70780793
(4aS*,7aR*)-1-(1H-imidazol-2-ylmethyl)-4-(3-methyl-2-buten-1-yl)octahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70783585
2-cyclopentylsulfonyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 72150054
2-ethylsulfonyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 72150097
2-Methyl-1-[(1-methylimidazol-2-yl)methyl]-4-(2-methylsulfonylethyl)piperazine
CID 53594681
(4aR*,7aS*)-1-methyl-4-[(1-methyl-1H-imidazol-2-yl)methyl]octahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70728375
(4aS*,7aR*)-1-[(1-ethyl-1H-imidazol-2-yl)methyl]-4-propyloctahydrothieno[3,4-b]pyrazine 6,6-dioxide
CID 70744632
1-(1,1-Dioxothiolan-3-yl)-3-(2-imidazol-1-ylethyl)urea
CID 71894170
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 86774804

Frequently Asked Questions

What is the IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine?
The IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine (CID 55150345) is 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine.
What is the SMILES notation for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine?
The canonical SMILES for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine is NC1CS(=O)(=O)CC1N1CCn2ccnc2C1.
What is the InChIKey of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine?
The InChIKey is IOGSKCJHSJOLAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c11-8-6-17(15,16)7-9(8)14-4-3-13-2-1-12-10(13)5-14/h1-2,8-9H,3-7,11H2.
What are the key properties of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine?
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine has a molecular weight of 256.33 g/mol, XLogP of -1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,1-dioxothiolan-3-amine is sourced from PubChem (CID 55150345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).