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

C13H17N5S — CID 43777167

IUPACN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
SMILESCc1n[nH]c(C)c1NCc1c(C)nc2scc(C)n12
InChIInChI=1S/C13H17N5S/c1-7-6-19-13-15-8(2)11(18(7)13)5-14-12-9(3)16-17-10(12)4/h6,14H,5H2,1-4H3,(H,16,17)
InChIKeyMMSRCLLVKIDZKP-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.96
Rot. Bonds3

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

N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine (PubChem CID 43777167) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine.

Molecular Properties

Compound NameN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
PubChem CID43777167
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC NameN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
SMILESCc1n[nH]c(C)c1NCc1c(C)nc2scc(C)n12
InChIInChI=1S/C13H17N5S/c1-7-6-19-13-15-8(2)11(18(7)13)5-14-12-9(3)16-17-10(12)4/h6,14H,5H2,1-4H3,(H,16,17)
InChIKeyMMSRCLLVKIDZKP-UHFFFAOYSA-N
XLogP2.96
TPSA58.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
CID 43625905
3-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-2,6-dimethylphenol
CID 43790156
1-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-2-methylpropan-2-ol
CID 65103083
2-bromo-N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 43762589
2-chloro-N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 43763042
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,4-difluoroaniline
CID 43761570
2,3-dichloro-N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 43772146
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]oxan-4-amine
CID 43778482
1-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-2-methylbutan-2-ol
CID 65108373
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine
CID 106281929
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-iodoaniline
CID 43773323
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-ethylaniline
CID 43765094

Frequently Asked Questions

What is the IUPAC name of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine?
The IUPAC name of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine (CID 43777167) is N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine.
What is the SMILES notation for N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine?
The canonical SMILES for N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine is Cc1n[nH]c(C)c1NCc1c(C)nc2scc(C)n12.
What is the InChIKey of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine?
The InChIKey is MMSRCLLVKIDZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-7-6-19-13-15-8(2)11(18(7)13)5-14-12-9(3)16-17-10(12)4/h6,14H,5H2,1-4H3,(H,16,17).
What are the key properties of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine?
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine has a molecular weight of 275.38 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine is sourced from PubChem (CID 43777167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).