1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine

C15H28N2OS — CID 116761111

IUPAC1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine
SMILESCCNC(Cc1nc(C)c(C)s1)C(CC)(CC)OC
InChIInChI=1S/C15H28N2OS/c1-7-15(8-2,18-6)13(16-9-3)10-14-17-11(4)12(5)19-14/h13,16H,7-10H2,1-6H3
InChIKeyRNHCGCLGRCRCNU-UHFFFAOYSA-N
MW284.47 g/mol
LogP3.49
Rot. Bonds8

About 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine (PubChem CID 116761111) has the molecular formula C15H28N2OS and a molecular weight of 284.47 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine
PubChem CID116761111
Molecular FormulaC15H28N2OS
Molecular Weight284.47 g/mol
Exact Mass284.19
IUPAC Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine
SMILESCCNC(Cc1nc(C)c(C)s1)C(CC)(CC)OC
InChIInChI=1S/C15H28N2OS/c1-7-15(8-2,18-6)13(16-9-3)10-14-17-11(4)12(5)19-14/h13,16H,7-10H2,1-6H3
InChIKeyRNHCGCLGRCRCNU-UHFFFAOYSA-N
XLogP3.49
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.47
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine
CID 105171727
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-3-methoxypentan-2-amine
CID 116715677
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 105240784
1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-methoxy-N-methylhexan-2-amine
CID 116718790
[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-ethoxy-3-methylbutan-2-yl]hydrazine
CID 105273954
1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-methoxy-4-methylpentan-2-amine
CID 103028643
N,3-diethyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methoxypentan-2-amine
CID 116761301
2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-1-(2-methylsulfanylphenyl)ethanamine
CID 105019741
2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-1-(3-methoxy-4-pyridinyl)ethanamine
CID 105065910
1-(4,5-dimethyl-1,3-thiazol-2-yl)pentan-2-amine
CID 65168639
N,3-diethyl-3-methoxytridecan-4-amine
CID 116761089
1-(3-bromo-2-methylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethylethanamine
CID 105019688

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine?
The IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine (CID 116761111) is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine.
What is the SMILES notation for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine?
The canonical SMILES for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine is CCNC(Cc1nc(C)c(C)s1)C(CC)(CC)OC.
What is the InChIKey of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine?
The InChIKey is RNHCGCLGRCRCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2OS/c1-7-15(8-2,18-6)13(16-9-3)10-14-17-11(4)12(5)19-14/h13,16H,7-10H2,1-6H3.
What are the key properties of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine?
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine has a molecular weight of 284.47 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N,3-diethyl-3-methoxypentan-2-amine is sourced from PubChem (CID 116761111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).