1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine

C15H25N5S — CID 81464392

IUPAC1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCC(N)Cc1c(N2CC(C)C(N(C)C)C2)nc2sccn12
InChIInChI=1S/C15H25N5S/c1-10-8-19(9-13(10)18(3)4)14-12(7-11(2)16)20-5-6-21-15(20)17-14/h5-6,10-11,13H,7-9,16H2,1-4H3
InChIKeyMGDLTZMQSKGGMT-UHFFFAOYSA-N
MW307.47 g/mol
LogP1.67
Rot. Bonds4

About 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine

1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine (PubChem CID 81464392) has the molecular formula C15H25N5S and a molecular weight of 307.47 g/mol. Its IUPAC name is 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine
PubChem CID81464392
Molecular FormulaC15H25N5S
Molecular Weight307.47 g/mol
Exact Mass307.18
IUPAC Name1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCC(N)Cc1c(N2CC(C)C(N(C)C)C2)nc2sccn12
InChIInChI=1S/C15H25N5S/c1-10-8-19(9-13(10)18(3)4)14-12(7-11(2)16)20-5-6-21-15(20)17-14/h5-6,10-11,13H,7-9,16H2,1-4H3
InChIKeyMGDLTZMQSKGGMT-UHFFFAOYSA-N
XLogP1.67
TPSA49.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.47
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]butan-2-amine
CID 79183887
1-(6-piperidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)propan-2-amine
CID 63785604
2-[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 79183495
1-[5-(2-aminobutyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N-dimethylpyrrolidin-3-amine
CID 63795058
1-[6-(2-methylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 55237176
1-[6-(3-ethoxypiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63817268
N-[[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 79188181
1-[6-(4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]butan-2-amine
CID 63785740
1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-3-methylpiperidin-4-ol
CID 114679350
1-[6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63793480
1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63815717
5-(2-aminopropyl)-N-butyl-N-cyclopropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63816316

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine?
The IUPAC name of 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine (CID 81464392) is 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine is CC(N)Cc1c(N2CC(C)C(N(C)C)C2)nc2sccn12.
What is the InChIKey of 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine?
The InChIKey is MGDLTZMQSKGGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5S/c1-10-8-19(9-13(10)18(3)4)14-12(7-11(2)16)20-5-6-21-15(20)17-14/h5-6,10-11,13H,7-9,16H2,1-4H3.
What are the key properties of 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine?
1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine has a molecular weight of 307.47 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine is sourced from PubChem (CID 81464392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).