(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide

C11H20N4O3S — CID 97421818

IUPAC(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
SMILESCOCc1cnc2n1CCN(S(=O)(=O)N(C)C)[C@H]2C
InChIInChI=1S/C11H20N4O3S/c1-9-11-12-7-10(8-18-4)14(11)5-6-15(9)19(16,17)13(2)3/h7,9H,5-6,8H2,1-4H3/t9-/m0/s1
InChIKeyBJVCNXRIAXZAIM-VIFPVBQESA-N
MW288.37 g/mol
LogP0.21
Rot. Bonds4

About (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide

(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide (PubChem CID 97421818) has the molecular formula C11H20N4O3S and a molecular weight of 288.37 g/mol. Its IUPAC name is (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide.

Molecular Properties

Compound Name(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
PubChem CID97421818
Molecular FormulaC11H20N4O3S
Molecular Weight288.37 g/mol
Exact Mass288.13
IUPAC Name(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
SMILESCOCc1cnc2n1CCN(S(=O)(=O)N(C)C)[C@H]2C
InChIInChI=1S/C11H20N4O3S/c1-9-11-12-7-10(8-18-4)14(11)5-6-15(9)19(16,17)13(2)3/h7,9H,5-6,8H2,1-4H3/t9-/m0/s1
InChIKeyBJVCNXRIAXZAIM-VIFPVBQESA-N
XLogP0.21
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5H,6H,8H-imidazo(4,3-c)(1,4)oxazine
CID 14368849
{5H,6H,8H-imidazo[2,1-c][1,4]oxazin-3-yl}methanol
CID 132363509
N-[[7-(2-methoxyethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine
CID 97471136
3-(cyclopropylmethoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
CID 118738848
3-(cyclopentylmethoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
CID 118738854
3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide
CID 118738866
8-methyl-7-methylsulfonyl-3-(oxan-4-ylmethoxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118739000
3-(cyclopropylmethoxymethyl)-7,8-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118742725
8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118742735
7-cyclobutyl-3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118743401
7-cyclopentyl-3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118743403
19-Methyl-3,6,9,12,15-pentaoxa-19,20-diazabicyclo[15.2.1]-icosa-1(20),17-diene
CID 164575614

Frequently Asked Questions

What is the IUPAC name of (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide?
The IUPAC name of (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide (CID 97421818) is (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide.
What is the SMILES notation for (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide?
The canonical SMILES for (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide is COCc1cnc2n1CCN(S(=O)(=O)N(C)C)[C@H]2C.
What is the InChIKey of (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide?
The InChIKey is BJVCNXRIAXZAIM-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20N4O3S/c1-9-11-12-7-10(8-18-4)14(11)5-6-15(9)19(16,17)13(2)3/h7,9H,5-6,8H2,1-4H3/t9-/m0/s1.
What are the key properties of (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide?
(8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide has a molecular weight of 288.37 g/mol, XLogP of 0.21, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-3-(methoxymethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-sulfonamide is sourced from PubChem (CID 97421818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).