N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine

C16H20N4S — CID 105174226

IUPACN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)c1cncc(C)c1
InChIInChI=1S/C16H20N4S/c1-3-4-18-15(13-7-12(2)9-17-10-13)8-14-11-20-5-6-21-16(20)19-14/h5-7,9-11,15,18H,3-4,8H2,1-2H3
InChIKeyWXJNQPMPTNBRPZ-UHFFFAOYSA-N
MW300.43 g/mol
LogP3.38
Rot. Bonds6

About N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine

N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine (PubChem CID 105174226) has the molecular formula C16H20N4S and a molecular weight of 300.43 g/mol. Its IUPAC name is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
PubChem CID105174226
Molecular FormulaC16H20N4S
Molecular Weight300.43 g/mol
Exact Mass300.14
IUPAC NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)c1cncc(C)c1
InChIInChI=1S/C16H20N4S/c1-3-4-18-15(13-7-12(2)9-17-10-13)8-14-11-20-5-6-21-16(20)19-14/h5-7,9-11,15,18H,3-4,8H2,1-2H3
InChIKeyWXJNQPMPTNBRPZ-UHFFFAOYSA-N
XLogP3.38
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethanamine
CID 105174221
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyridin-3-ylethyl)propan-1-amine
CID 115333445
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-phenylethyl)propan-1-amine
CID 115333467
N-[1-(3-chlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]propan-1-amine
CID 115333433
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105174053
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methylfuran-3-yl)ethyl]propan-1-amine
CID 104790414
N-[1-(2,5-dibromothiophen-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]propan-1-amine
CID 107968859
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 115333944
[1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105328770
1-(3-chloro-4-methylphenyl)-N-ethyl-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 105023712
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methyl-N-propylpentan-2-amine
CID 115332398
N-ethyl-1-(4-fluoro-3-methylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333503

Frequently Asked Questions

What is the IUPAC name of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine?
The IUPAC name of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine (CID 105174226) is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine is CCCNC(Cc1cn2ccsc2n1)c1cncc(C)c1.
What is the InChIKey of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine?
The InChIKey is WXJNQPMPTNBRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4S/c1-3-4-18-15(13-7-12(2)9-17-10-13)8-14-11-20-5-6-21-16(20)19-14/h5-7,9-11,15,18H,3-4,8H2,1-2H3.
What are the key properties of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine?
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine has a molecular weight of 300.43 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine is sourced from PubChem (CID 105174226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).