4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine

C17H27N3S — CID 105023529

IUPAC4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
SMILESCCCNC(CCC1CCCC1)Cc1cn2ccsc2n1
InChIInChI=1S/C17H27N3S/c1-2-9-18-15(8-7-14-5-3-4-6-14)12-16-13-20-10-11-21-17(20)19-16/h10-11,13-15,18H,2-9,12H2,1H3
InChIKeyNXWPJRLKDVRKQY-UHFFFAOYSA-N
MW305.49 g/mol
LogP4.28
Rot. Bonds8

About 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine

4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine (PubChem CID 105023529) has the molecular formula C17H27N3S and a molecular weight of 305.49 g/mol. Its IUPAC name is 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
PubChem CID105023529
Molecular FormulaC17H27N3S
Molecular Weight305.49 g/mol
Exact Mass305.19
IUPAC Name4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
SMILESCCCNC(CCC1CCCC1)Cc1cn2ccsc2n1
InChIInChI=1S/C17H27N3S/c1-2-9-18-15(8-7-14-5-3-4-6-14)12-16-13-20-10-11-21-17(20)19-16/h10-11,13-15,18H,2-9,12H2,1H3
InChIKeyNXWPJRLKDVRKQY-UHFFFAOYSA-N
XLogP4.28
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.49
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-cyclohexyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-yl)hydrazine
CID 105328743
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylsulfanyl-N-propylbutan-2-amine
CID 105174072
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-(2-methoxyethoxy)-N-propylbutan-2-amine
CID 102928656
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 115333706
1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 113289267
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115333734
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methyl-N-propylpentan-2-amine
CID 115332398
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
(1-cyclohexylsulfanyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl)hydrazine
CID 105227723
1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 115333760
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-propylpentan-1-amine
CID 113289314
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-phenylethyl)propan-1-amine
CID 115333467

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine?
The IUPAC name of 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine (CID 105023529) is 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine.
What is the SMILES notation for 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine?
The canonical SMILES for 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine is CCCNC(CCC1CCCC1)Cc1cn2ccsc2n1.
What is the InChIKey of 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine?
The InChIKey is NXWPJRLKDVRKQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3S/c1-2-9-18-15(8-7-14-5-3-4-6-14)12-16-13-20-10-11-21-17(20)19-16/h10-11,13-15,18H,2-9,12H2,1H3.
What are the key properties of 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine?
4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine has a molecular weight of 305.49 g/mol, XLogP of 4.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine is sourced from PubChem (CID 105023529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).