4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine

C11H14ClN7 — CID 55144623

IUPAC4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(Cl)nc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C11H14ClN7/c1-17(2)10-14-9(12)15-11(16-10)19-6-5-18-4-3-13-8(18)7-19/h3-4H,5-7H2,1-2H3
InChIKeyHKTKESLVHADHES-UHFFFAOYSA-N
MW279.74 g/mol
LogP0.81
Rot. Bonds2

About 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine

4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine (PubChem CID 55144623) has the molecular formula C11H14ClN7 and a molecular weight of 279.74 g/mol. Its IUPAC name is 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
PubChem CID55144623
Molecular FormulaC11H14ClN7
Molecular Weight279.74 g/mol
Exact Mass279.10
IUPAC Name4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(Cl)nc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C11H14ClN7/c1-17(2)10-14-9(12)15-11(16-10)19-6-5-18-4-3-13-8(18)7-19/h3-4H,5-7H2,1-2H3
InChIKeyHKTKESLVHADHES-UHFFFAOYSA-N
XLogP0.81
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.74
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine (CID 55144623) is 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine is CN(C)c1nc(Cl)nc(N2CCn3ccnc3C2)n1.
What is the InChIKey of 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is HKTKESLVHADHES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN7/c1-17(2)10-14-9(12)15-11(16-10)19-6-5-18-4-3-13-8(18)7-19/h3-4H,5-7H2,1-2H3.
What are the key properties of 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 279.74 g/mol, XLogP of 0.81, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 55144623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).