[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone

C25H30N8OS — CID 170682916

IUPAC[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone
SMILESCc1nc(C(=O)N2CCc3nc(N)sc3C2)c(N)nc1N1CCC2(CC1)Cc1ccccc1C2N
InChIInChI=1S/C25H30N8OS/c1-14-22(32-10-7-25(8-11-32)12-15-4-2-3-5-16(15)20(25)26)31-21(27)19(29-14)23(34)33-9-6-17-18(13-33)35-24(28)30-17/h2-5,20H,6-13,26H2,1H3,(H2,27,31)(H2,28,30)
InChIKeyFHXWRGSNIXNJGA-UHFFFAOYSA-N
MW490.64 g/mol
LogP2.45
Rot. Bonds2

About [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone

[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone (PubChem CID 170682916) has the molecular formula C25H30N8OS and a molecular weight of 490.64 g/mol. Its IUPAC name is [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Name[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone
PubChem CID170682916
Molecular FormulaC25H30N8OS
Molecular Weight490.64 g/mol
Exact Mass490.23
IUPAC Name[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone
SMILESCc1nc(C(=O)N2CCc3nc(N)sc3C2)c(N)nc1N1CCC2(CC1)Cc1ccccc1C2N
InChIInChI=1S/C25H30N8OS/c1-14-22(32-10-7-25(8-11-32)12-15-4-2-3-5-16(15)20(25)26)31-21(27)19(29-14)23(34)33-9-6-17-18(13-33)35-24(28)30-17/h2-5,20H,6-13,26H2,1H3,(H2,27,31)(H2,28,30)
InChIKeyFHXWRGSNIXNJGA-UHFFFAOYSA-N
XLogP2.45
TPSA140.28 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.64
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone with MolForge

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Related Compounds

[3-amino-5-[(1S)-1-amino-6-methylspiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]pyrazin-2-yl]-(2-amino-7,7-dideuterio-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone
CID 170682891
[3-amino-5-(1-amino-6-fluorospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)pyrazin-2-yl]-(2-amino-7,7-difluoro-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone
CID 170682967
(R)-N-[1'-[6-amino-5-(2-amino-7,7-dimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-5-carbonyl)pyrazin-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-yl]-2-methylpropane-2-sulfinamide
CID 170683025
methyl 3-[(1S)-1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]pyrazine-2-carboxylate;hydrochloride
CID 155774294
1-[5-amino-6-[(2-amino-4-pyridinyl)sulfanyl]-3-[(1S)-1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]pyrazin-2-yl]ethanone
CID 172500518
(1S)-1'-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;methane
CID 159252841
(1S)-1'-[6-amino-5-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-3-bromopyrazin-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;(1S)-1'-[6-amino-5-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-3-methylpyrazin-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 163936991
[3-[(1R)-1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]-5-methylpyrazin-2-yl]methanol;hydrochloride
CID 155774215
[3-amino-5-[(1S)-1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]pyrazin-2-yl]-(5-amino-2,3-dihydroindol-1-yl)methanone
CID 170682894
(5-amino-2,3-dihydropyrrolo[3,2-b]pyridin-1-yl)-[5-[(1S)-1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl]-6-(hydroxymethyl)pyrazin-2-yl]methanone
CID 170682927
(1R)-1'-methylspiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 167047869
(1S)-1'-[5-(3,6-dihydro-2H-pyran-4-yl)-3-methylpyrrolo[2,3-b]pyrazin-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 155774319

Frequently Asked Questions

What is the IUPAC name of [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone?
The IUPAC name of [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone (CID 170682916) is [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone.
What is the SMILES notation for [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone?
The canonical SMILES for [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone is Cc1nc(C(=O)N2CCc3nc(N)sc3C2)c(N)nc1N1CCC2(CC1)Cc1ccccc1C2N.
What is the InChIKey of [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone?
The InChIKey is FHXWRGSNIXNJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N8OS/c1-14-22(32-10-7-25(8-11-32)12-15-4-2-3-5-16(15)20(25)26)31-21(27)19(29-14)23(34)33-9-6-17-18(13-33)35-24(28)30-17/h2-5,20H,6-13,26H2,1H3,(H2,27,31)(H2,28,30).
What are the key properties of [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone?
[3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone has a molecular weight of 490.64 g/mol, XLogP of 2.45, 2 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [3-amino-5-(1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-1'-yl)-6-methylpyrazin-2-yl]-(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methanone is sourced from PubChem (CID 170682916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).