(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone

C21H19N5OS — CID 176733462

IUPAC(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone
SMILESNc1c(C(=O)N2CCCCC2)sc2nc(-c3ccc4ncccc4c3)cnc12
InChIInChI=1S/C21H19N5OS/c22-17-18-20(28-19(17)21(27)26-9-2-1-3-10-26)25-16(12-24-18)14-6-7-15-13(11-14)5-4-8-23-15/h4-8,11-12H,1-3,9-10,22H2
InChIKeyLWNJWGILFZFLAL-UHFFFAOYSA-N
MW389.48 g/mol
LogP4.11
Rot. Bonds2

About (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone

(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone (PubChem CID 176733462) has the molecular formula C21H19N5OS and a molecular weight of 389.48 g/mol. Its IUPAC name is (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone
PubChem CID176733462
Molecular FormulaC21H19N5OS
Molecular Weight389.48 g/mol
Exact Mass389.13
IUPAC Name(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone
SMILESNc1c(C(=O)N2CCCCC2)sc2nc(-c3ccc4ncccc4c3)cnc12
InChIInChI=1S/C21H19N5OS/c22-17-18-20(28-19(17)21(27)26-9-2-1-3-10-26)25-16(12-24-18)14-6-7-15-13(11-14)5-4-8-23-15/h4-8,11-12H,1-3,9-10,22H2
InChIKeyLWNJWGILFZFLAL-UHFFFAOYSA-N
XLogP4.11
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone with MolForge

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Related Compounds

[7-amino-3-(1-methylindazol-5-yl)thieno[2,3-b]pyrazin-6-yl]-piperidin-1-ylmethanone
CID 176733458
(7-amino-3-phenylthieno[2,3-b]pyrazin-6-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
CID 176733493
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
CID 23943390
(7-amino-3-phenylthieno[2,3-b]pyrazin-6-yl)-(2-oxa-6-azaspiro[3.3]heptan-6-yl)methanone
CID 176733499
(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
CID 122624340
[3-(4-aminophenyl)quinoxalin-6-yl]-piperidin-1-ylmethanone
CID 135300412
(3-amino-7-methoxythieno[2,3-b]quinolin-2-yl)-piperidin-1-ylmethanone
CID 865126
6-quinolin-6-ylpyrazin-2-amine
CID 81222208
(3-amino-7,8-dimethylthieno[2,3-b]quinolin-2-yl)-(azepan-1-yl)methanone
CID 1442782
2-methyl-2-piperidin-1-yl-1-quinolin-6-ylpropan-1-one
CID 81198324
pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone
CID 22577871
(4-amino-3-pyridin-2-yl-1,2-thiazol-5-yl)-pyrrolidin-1-ylmethanone
CID 53141249

Frequently Asked Questions

What is the IUPAC name of (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone?
The IUPAC name of (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone (CID 176733462) is (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone is Nc1c(C(=O)N2CCCCC2)sc2nc(-c3ccc4ncccc4c3)cnc12.
What is the InChIKey of (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone?
The InChIKey is LWNJWGILFZFLAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5OS/c22-17-18-20(28-19(17)21(27)26-9-2-1-3-10-26)25-16(12-24-18)14-6-7-15-13(11-14)5-4-8-23-15/h4-8,11-12H,1-3,9-10,22H2.
What are the key properties of (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone?
(7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone has a molecular weight of 389.48 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7-amino-3-quinolin-6-ylthieno[2,3-b]pyrazin-6-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 176733462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).