(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine

C24H30N6S — CID 146467007

IUPAC(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
SMILESN[C@@H]1CCCC12CCN(c1ncc(Sc3ccnc4c3CCCC4)c3nccn13)CC2
InChIInChI=1S/C24H30N6S/c25-21-6-3-8-24(21)9-13-29(14-10-24)23-28-16-20(22-27-12-15-30(22)23)31-19-7-11-26-18-5-2-1-4-17(18)19/h7,11-12,15-16,21H,1-6,8-10,13-14,25H2/t21-/m1/s1
InChIKeyQQSJCXNSSYOJIT-OAQYLSRUSA-N
MW434.61 g/mol
LogP4.25
Rot. Bonds3

About (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine

(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine (PubChem CID 146467007) has the molecular formula C24H30N6S and a molecular weight of 434.61 g/mol. Its IUPAC name is (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
PubChem CID146467007
Molecular FormulaC24H30N6S
Molecular Weight434.61 g/mol
Exact Mass434.23
IUPAC Name(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
SMILESN[C@@H]1CCCC12CCN(c1ncc(Sc3ccnc4c3CCCC4)c3nccn13)CC2
InChIInChI=1S/C24H30N6S/c25-21-6-3-8-24(21)9-13-29(14-10-24)23-28-16-20(22-27-12-15-30(22)23)31-19-7-11-26-18-5-2-1-4-17(18)19/h7,11-12,15-16,21H,1-6,8-10,13-14,25H2/t21-/m1/s1
InChIKeyQQSJCXNSSYOJIT-OAQYLSRUSA-N
XLogP4.25
TPSA72.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.61
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine (CID 146467007) is (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine is N[C@@H]1CCCC12CCN(c1ncc(Sc3ccnc4c3CCCC4)c3nccn13)CC2.
What is the InChIKey of (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?
The InChIKey is QQSJCXNSSYOJIT-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H30N6S/c25-21-6-3-8-24(21)9-13-29(14-10-24)23-28-16-20(22-27-12-15-30(22)23)31-19-7-11-26-18-5-2-1-4-17(18)19/h7,11-12,15-16,21H,1-6,8-10,13-14,25H2/t21-/m1/s1.
What are the key properties of (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine?
(4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine has a molecular weight of 434.61 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-[8-(5,6,7,8-tetrahydroquinolin-4-ylsulfanyl)imidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 146467007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).