N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine

C11H15N3S — CID 79340574

IUPACN,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine
SMILESCNCC(C)=Cc1c(C)nc2sccn12
InChIInChI=1S/C11H15N3S/c1-8(7-12-3)6-10-9(2)13-11-14(10)4-5-15-11/h4-6,12H,7H2,1-3H3
InChIKeyMUULHOKXPLQVAM-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.33
Rot. Bonds3

About N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine

N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine (PubChem CID 79340574) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine
PubChem CID79340574
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC NameN,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine
SMILESCNCC(C)=Cc1c(C)nc2sccn12
InChIInChI=1S/C11H15N3S/c1-8(7-12-3)6-10-9(2)13-11-14(10)4-5-15-11/h4-6,12H,7H2,1-3H3
InChIKeyMUULHOKXPLQVAM-UHFFFAOYSA-N
XLogP2.33
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine?
The IUPAC name of N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine (CID 79340574) is N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine.
What is the SMILES notation for N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine?
The canonical SMILES for N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine is CNCC(C)=Cc1c(C)nc2sccn12.
What is the InChIKey of N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine?
The InChIKey is MUULHOKXPLQVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-8(7-12-3)6-10-9(2)13-11-14(10)4-5-15-11/h4-6,12H,7H2,1-3H3.
What are the key properties of N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine?
N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine has a molecular weight of 221.33 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-en-1-amine is sourced from PubChem (CID 79340574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).