1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine

C13H20N4OS — CID 106571790

IUPAC1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
SMILESCOCC(C)n1ccnc1NCCc1nc(C)cs1
InChIInChI=1S/C13H20N4OS/c1-10-9-19-12(16-10)4-5-14-13-15-6-7-17(13)11(2)8-18-3/h6-7,9,11H,4-5,8H2,1-3H3,(H,14,15)
InChIKeyQSIJOZIQJWUOEA-UHFFFAOYSA-N
MW280.40 g/mol
LogP2.51
Rot. Bonds7

About 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine

1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine (PubChem CID 106571790) has the molecular formula C13H20N4OS and a molecular weight of 280.40 g/mol. Its IUPAC name is 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound Name1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
PubChem CID106571790
Molecular FormulaC13H20N4OS
Molecular Weight280.40 g/mol
Exact Mass280.14
IUPAC Name1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
SMILESCOCC(C)n1ccnc1NCCc1nc(C)cs1
InChIInChI=1S/C13H20N4OS/c1-10-9-19-12(16-10)4-5-14-13-15-6-7-17(13)11(2)8-18-3/h6-7,9,11H,4-5,8H2,1-3H3,(H,14,15)
InChIKeyQSIJOZIQJWUOEA-UHFFFAOYSA-N
XLogP2.51
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.40
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1-propan-2-ylimidazol-2-amine
CID 106571805
1-(1-methoxypropan-2-yl)-N-(2-pyridin-2-ylethyl)imidazol-2-amine
CID 106554399
N-(2,2-dimethylpropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106563648
1-(1-methoxypropan-2-yl)-N-(2-pyrrolidin-1-ylethyl)imidazol-2-amine
CID 106570244
1-cyclopentyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571823
1-(1-methoxypropan-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine
CID 106571991
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
CID 106568458
3-methoxy-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridin-2-amine
CID 113370918
N-(2-methoxyethyl)-1-propan-2-ylimidazol-2-amine
CID 106554838
N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106581219
1,4-dimethyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571807
2-N-[1-(1-methoxypropan-2-yl)imidazol-2-yl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 106578621

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine (CID 106571790) is 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine is COCC(C)n1ccnc1NCCc1nc(C)cs1.
What is the InChIKey of 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
The InChIKey is QSIJOZIQJWUOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4OS/c1-10-9-19-12(16-10)4-5-14-13-15-6-7-17(13)11(2)8-18-3/h6-7,9,11H,4-5,8H2,1-3H3,(H,14,15).
What are the key properties of 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine?
1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine has a molecular weight of 280.40 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106571790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).