1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine

C14H26N2OS — CID 105171727

IUPAC1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine
SMILESCCNC(CCC(C)OC)Cc1nc(C)c(C)s1
InChIInChI=1S/C14H26N2OS/c1-6-15-13(8-7-10(2)17-5)9-14-16-11(3)12(4)18-14/h10,13,15H,6-9H2,1-5H3
InChIKeyDWKPCZPKXVLYCC-UHFFFAOYSA-N
MW270.44 g/mol
LogP3.10
Rot. Bonds8

About 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine (PubChem CID 105171727) has the molecular formula C14H26N2OS and a molecular weight of 270.44 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine
PubChem CID105171727
Molecular FormulaC14H26N2OS
Molecular Weight270.44 g/mol
Exact Mass270.18
IUPAC Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine
SMILESCCNC(CCC(C)OC)Cc1nc(C)c(C)s1
InChIInChI=1S/C14H26N2OS/c1-6-15-13(8-7-10(2)17-5)9-14-16-11(3)12(4)18-14/h10,13,15H,6-9H2,1-5H3
InChIKeyDWKPCZPKXVLYCC-UHFFFAOYSA-N
XLogP3.10
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.44
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-methoxy-1-(1,3-thiazol-2-yl)hexan-2-amine
CID 105169125
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,3-diethyl-3-methoxypentan-2-amine
CID 116761111
1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-methoxy-N-methylhexan-2-amine
CID 116718790
1-(cyclohexen-1-yl)-3-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethylpropan-2-amine
CID 116661749
N-ethyl-1-(1-ethylpyrazol-4-yl)-5-methoxyhexan-2-amine
CID 105114560
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)-N-methylpropan-2-amine
CID 64989566
[1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(2-methoxyethoxy)butan-2-yl]hydrazine
CID 102929930
1-(2,3-difluorophenyl)-N-ethyl-5-methoxyhexan-2-amine
CID 105137719
N-ethyl-4-methoxy-1-(2-methylthiophen-3-yl)pentan-1-amine
CID 102840306
1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(oxan-2-yl)-N-propylbutan-2-amine
CID 105019959

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine?
The IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine (CID 105171727) is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine.
What is the SMILES notation for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine?
The canonical SMILES for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine is CCNC(CCC(C)OC)Cc1nc(C)c(C)s1.
What is the InChIKey of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine?
The InChIKey is DWKPCZPKXVLYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2OS/c1-6-15-13(8-7-10(2)17-5)9-14-16-11(3)12(4)18-14/h10,13,15H,6-9H2,1-5H3.
What are the key properties of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine?
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-ethyl-5-methoxyhexan-2-amine has a molecular weight of 270.44 g/mol, XLogP of 3.10, 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-ethyl-5-methoxyhexan-2-amine is sourced from PubChem (CID 105171727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).