N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine

C13H17N5S — CID 43625903

IUPACN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine
SMILESCCn1cc(NCc2c(C)nc3sc(C)cn23)cn1
InChIInChI=1S/C13H17N5S/c1-4-17-8-11(5-15-17)14-6-12-10(3)16-13-18(12)7-9(2)19-13/h5,7-8,14H,4,6H2,1-3H3
InChIKeyXECQCSPPXRSNBG-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.84
Rot. Bonds4

About N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine (PubChem CID 43625903) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine.

Molecular Properties

Compound NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine
PubChem CID43625903
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine
SMILESCCn1cc(NCc2c(C)nc3sc(C)cn23)cn1
InChIInChI=1S/C13H17N5S/c1-4-17-8-11(5-15-17)14-6-12-10(3)16-13-18(12)7-9(2)19-13/h5,7-8,14H,4,6H2,1-3H3
InChIKeyXECQCSPPXRSNBG-UHFFFAOYSA-N
XLogP2.84
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-4-N,4-N-dimethylbenzene-1,4-diamine
CID 43625921
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-ethoxyaniline
CID 60936482
4-bromo-3-chloro-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 107619022
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-ethyl-1-methylpyrazol-4-amine
CID 103909047
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
CID 43625905
4-bromo-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-methoxyaniline
CID 79480555
3-bromo-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-4-methoxyaniline
CID 63999868
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79101097
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylpyrazol-3-amine
CID 60807858
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]hexan-1-amine
CID 43625829
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-ethoxypyridin-3-amine
CID 43706476
N,1-diethylpyrazol-4-amine
CID 43543394

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine?
The IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine (CID 43625903) is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine.
What is the SMILES notation for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine?
The canonical SMILES for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine is CCn1cc(NCc2c(C)nc3sc(C)cn23)cn1.
What is the InChIKey of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine?
The InChIKey is XECQCSPPXRSNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-4-17-8-11(5-15-17)14-6-12-10(3)16-13-18(12)7-9(2)19-13/h5,7-8,14H,4,6H2,1-3H3.
What are the key properties of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine?
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine has a molecular weight of 275.38 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-ethylpyrazol-4-amine is sourced from PubChem (CID 43625903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).