N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine

C15H24N4S — CID 75386771

IUPACN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine
SMILESCSCCC(C)N(C)Cc1cn2c(C)cc(C)nc2n1
InChIInChI=1S/C15H24N4S/c1-11-8-13(3)19-10-14(17-15(19)16-11)9-18(4)12(2)6-7-20-5/h8,10,12H,6-7,9H2,1-5H3
InChIKeyUXISVVSMIPJWBI-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.92
Rot. Bonds6

About N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine

N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine (PubChem CID 75386771) has the molecular formula C15H24N4S and a molecular weight of 292.45 g/mol. Its IUPAC name is N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine.

Molecular Properties

Compound NameN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine
PubChem CID75386771
Molecular FormulaC15H24N4S
Molecular Weight292.45 g/mol
Exact Mass292.17
IUPAC NameN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine
SMILESCSCCC(C)N(C)Cc1cn2c(C)cc(C)nc2n1
InChIInChI=1S/C15H24N4S/c1-11-8-13(3)19-10-14(17-15(19)16-11)9-18(4)12(2)6-7-20-5/h8,10,12H,6-7,9H2,1-5H3
InChIKeyUXISVVSMIPJWBI-UHFFFAOYSA-N
XLogP2.92
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine?
The IUPAC name of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine (CID 75386771) is N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine.
What is the SMILES notation for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine?
The canonical SMILES for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine is CSCCC(C)N(C)Cc1cn2c(C)cc(C)nc2n1.
What is the InChIKey of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine?
The InChIKey is UXISVVSMIPJWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4S/c1-11-8-13(3)19-10-14(17-15(19)16-11)9-18(4)12(2)6-7-20-5/h8,10,12H,6-7,9H2,1-5H3.
What are the key properties of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine?
N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine has a molecular weight of 292.45 g/mol, XLogP of 2.92, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methyl-4-methylsulfanylbutan-2-amine is sourced from PubChem (CID 75386771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).