N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine

C14H18N4S2 — CID 105174053

IUPACN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)c1csc(C)n1
InChIInChI=1S/C14H18N4S2/c1-3-4-15-12(13-9-20-10(2)16-13)7-11-8-18-5-6-19-14(18)17-11/h5-6,8-9,12,15H,3-4,7H2,1-2H3
InChIKeyOBYCSKOCRAFFGL-UHFFFAOYSA-N
MW306.46 g/mol
LogP3.44
Rot. Bonds6

About N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine

N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine (PubChem CID 105174053) has the molecular formula C14H18N4S2 and a molecular weight of 306.46 g/mol. Its IUPAC name is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
PubChem CID105174053
Molecular FormulaC14H18N4S2
Molecular Weight306.46 g/mol
Exact Mass306.10
IUPAC NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)c1csc(C)n1
InChIInChI=1S/C14H18N4S2/c1-3-4-15-12(13-9-20-10(2)16-13)7-11-8-18-5-6-19-14(18)17-11/h5-6,8-9,12,15H,3-4,7H2,1-2H3
InChIKeyOBYCSKOCRAFFGL-UHFFFAOYSA-N
XLogP3.44
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.46
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105174090
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 115333944
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-phenylethyl)propan-1-amine
CID 115333467
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methylfuran-3-yl)ethyl]propan-1-amine
CID 104790414
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 105174226
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyridin-3-ylethyl)propan-1-amine
CID 115333445
N-[1-(2,5-dibromothiophen-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]propan-1-amine
CID 107968859
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 115333706
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylsulfanyl-N-propylbutan-2-amine
CID 105174072
N-[1-(3-chlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]propan-1-amine
CID 115333433
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methyl-N-propylpentan-2-amine
CID 115332398
1-(2-methyl-1,3-thiazol-4-yl)-N-propylpropan-1-amine
CID 105078510

Frequently Asked Questions

What is the IUPAC name of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine?
The IUPAC name of 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) is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine is CCCNC(Cc1cn2ccsc2n1)c1csc(C)n1.
What is the InChIKey of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine?
The InChIKey is OBYCSKOCRAFFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S2/c1-3-4-15-12(13-9-20-10(2)16-13)7-11-8-18-5-6-19-14(18)17-11/h5-6,8-9,12,15H,3-4,7H2,1-2H3.
What are the key properties of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine?
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine has a molecular weight of 306.46 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine is sourced from PubChem (CID 105174053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).