N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C15H20N4OS — CID 133141017

IUPACN,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC1c2nc(C(=O)N(C)C)cn2CCN1Cc1ccsc1
InChIInChI=1S/C15H20N4OS/c1-11-14-16-13(15(20)17(2)3)9-19(14)6-5-18(11)8-12-4-7-21-10-12/h4,7,9-11H,5-6,8H2,1-3H3
InChIKeyLSGWIWFKEMBAFY-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.22
Rot. Bonds3

About N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 133141017) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID133141017
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC NameN,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC1c2nc(C(=O)N(C)C)cn2CCN1Cc1ccsc1
InChIInChI=1S/C15H20N4OS/c1-11-14-16-13(15(20)17(2)3)9-19(14)6-5-18(11)8-12-4-7-21-10-12/h4,7,9-11H,5-6,8H2,1-3H3
InChIKeyLSGWIWFKEMBAFY-UHFFFAOYSA-N
XLogP2.22
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 133141017) is N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CC1c2nc(C(=O)N(C)C)cn2CCN1Cc1ccsc1.
What is the InChIKey of N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is LSGWIWFKEMBAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-11-14-16-13(15(20)17(2)3)9-19(14)6-5-18(11)8-12-4-7-21-10-12/h4,7,9-11H,5-6,8H2,1-3H3.
What are the key properties of N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 133141017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).