N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine

C12H23N3O2S — CID 62752566

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine
SMILESCNCc1cnc(N(CCOC)C(C)COC)s1
InChIInChI=1S/C12H23N3O2S/c1-10(9-17-4)15(5-6-16-3)12-14-8-11(18-12)7-13-2/h8,10,13H,5-7,9H2,1-4H3
InChIKeyZBZFQNLKKGHNBZ-UHFFFAOYSA-N
MW273.40 g/mol
LogP1.35
Rot. Bonds9

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine (PubChem CID 62752566) has the molecular formula C12H23N3O2S and a molecular weight of 273.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine
PubChem CID62752566
Molecular FormulaC12H23N3O2S
Molecular Weight273.40 g/mol
Exact Mass273.15
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine
SMILESCNCc1cnc(N(CCOC)C(C)COC)s1
InChIInChI=1S/C12H23N3O2S/c1-10(9-17-4)15(5-6-16-3)12-14-8-11(18-12)7-13-2/h8,10,13H,5-7,9H2,1-4H3
InChIKeyZBZFQNLKKGHNBZ-UHFFFAOYSA-N
XLogP1.35
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-5-(methylaminomethyl)-N-pentan-3-yl-1,3-thiazol-2-amine
CID 55112407
N-(1-methoxypropan-2-yl)-N-methyl-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 62752523
5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-propan-2-yl-1,3-thiazol-2-amine
CID 82966301
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-pentan-3-yl-1,3-thiazol-2-amine
CID 62752928
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-4-propyl-1,3-thiazol-2-amine
CID 62766894
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine
CID 80629569
5-(methylaminomethyl)-N,N-bis(3-methylbutyl)-1,3-thiazol-2-amine
CID 107871472
5-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-methyl-1,3-thiazol-2-amine
CID 62753971
N-(3-methoxypropyl)-N-methyl-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 63009419
N-(2-ethoxyethyl)-N-ethyl-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 63690743
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-4-(methylaminomethyl)pyridin-2-amine
CID 62289399
N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 55111975

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine (CID 62752566) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine is CNCc1cnc(N(CCOC)C(C)COC)s1.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine?
The InChIKey is ZBZFQNLKKGHNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2S/c1-10(9-17-4)15(5-6-16-3)12-14-8-11(18-12)7-13-2/h8,10,13H,5-7,9H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine has a molecular weight of 273.40 g/mol, XLogP of 1.35, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 62752566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).