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

C14H21N3OS — CID 115333734

IUPACN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)C1CCOC1
InChIInChI=1S/C14H21N3OS/c1-2-4-15-13(11-3-6-18-10-11)8-12-9-17-5-7-19-14(17)16-12/h5,7,9,11,13,15H,2-4,6,8,10H2,1H3
InChIKeySNZJKLCTHPPXLK-UHFFFAOYSA-N
MW279.41 g/mol
LogP2.34
Rot. Bonds6

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

N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine (PubChem CID 115333734) has the molecular formula C14H21N3OS and a molecular weight of 279.41 g/mol. Its IUPAC name is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine
PubChem CID115333734
Molecular FormulaC14H21N3OS
Molecular Weight279.41 g/mol
Exact Mass279.14
IUPAC NameN-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1cn2ccsc2n1)C1CCOC1
InChIInChI=1S/C14H21N3OS/c1-2-4-15-13(11-3-6-18-10-11)8-12-9-17-5-7-19-14(17)16-12/h5,7,9,11,13,15H,2-4,6,8,10H2,1H3
InChIKeySNZJKLCTHPPXLK-UHFFFAOYSA-N
XLogP2.34
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115333735
N-ethyl-1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333767
1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 113289267
4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
CID 105023529
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylsulfanyl-N-propylbutan-2-amine
CID 105174072
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methyl-N-propylpentan-2-amine
CID 115332398
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 115333706
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-phenylethyl)propan-1-amine
CID 115333467
[1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105233423
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-(2-methoxyethoxy)-N-propylbutan-2-amine
CID 102928656
4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine
CID 113289514
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

Frequently Asked Questions

What is the IUPAC name of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine (CID 115333734) is N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine is CCCNC(Cc1cn2ccsc2n1)C1CCOC1.
What is the InChIKey of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine?
The InChIKey is SNZJKLCTHPPXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3OS/c1-2-4-15-13(11-3-6-18-10-11)8-12-9-17-5-7-19-14(17)16-12/h5,7,9,11,13,15H,2-4,6,8,10H2,1H3.
What are the key properties of N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine?
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine has a molecular weight of 279.41 g/mol, XLogP of 2.34, 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-(oxolan-3-yl)ethyl]propan-1-amine is sourced from PubChem (CID 115333734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).