N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine

C21H26N4OS — CID 57396635

IUPACN-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESc1cn2c(NC3CCCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2s1
InChIInChI=1S/C21H26N4OS/c1-2-4-17(5-3-1)22-20-19(23-21-25(20)12-15-27-21)16-6-8-18(9-7-16)24-10-13-26-14-11-24/h6-9,12,15,17,22H,1-5,10-11,13-14H2
InChIKeyULCHJALZVCDNEC-UHFFFAOYSA-N
MW382.53 g/mol
LogP4.64
Rot. Bonds4

About N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine

N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 57396635) has the molecular formula C21H26N4OS and a molecular weight of 382.53 g/mol. Its IUPAC name is N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID57396635
Molecular FormulaC21H26N4OS
Molecular Weight382.53 g/mol
Exact Mass382.18
IUPAC NameN-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESc1cn2c(NC3CCCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2s1
InChIInChI=1S/C21H26N4OS/c1-2-4-17(5-3-1)22-20-19(23-21-25(20)12-15-27-21)16-6-8-18(9-7-16)24-10-13-26-14-11-24/h6-9,12,15,17,22H,1-5,10-11,13-14H2
InChIKeyULCHJALZVCDNEC-UHFFFAOYSA-N
XLogP4.64
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine (CID 57396635) is N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine is c1cn2c(NC3CCCCC3)c(-c3ccc(N4CCOCC4)cc3)nc2s1.
What is the InChIKey of N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is ULCHJALZVCDNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4OS/c1-2-4-17(5-3-1)22-20-19(23-21-25(20)12-15-27-21)16-6-8-18(9-7-16)24-10-13-26-14-11-24/h6-9,12,15,17,22H,1-5,10-11,13-14H2.
What are the key properties of N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 382.53 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(4-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 57396635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).