[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol

C14H24N2O2S — CID 107510864

IUPAC[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
SMILESCCN(c1nc(COC)c(CO)s1)C1CCCCC1
InChIInChI=1S/C14H24N2O2S/c1-3-16(11-7-5-4-6-8-11)14-15-12(10-18-2)13(9-17)19-14/h11,17H,3-10H2,1-2H3
InChIKeyXHFGRCUUOANANQ-UHFFFAOYSA-N
MW284.42 g/mol
LogP2.94
Rot. Bonds6

About [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol

[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 107510864) has the molecular formula C14H24N2O2S and a molecular weight of 284.42 g/mol. Its IUPAC name is [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
PubChem CID107510864
Molecular FormulaC14H24N2O2S
Molecular Weight284.42 g/mol
Exact Mass284.16
IUPAC Name[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
SMILESCCN(c1nc(COC)c(CO)s1)C1CCCCC1
InChIInChI=1S/C14H24N2O2S/c1-3-16(11-7-5-4-6-8-11)14-15-12(10-18-2)13(9-17)19-14/h11,17H,3-10H2,1-2H3
InChIKeyXHFGRCUUOANANQ-UHFFFAOYSA-N
XLogP2.94
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.42
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol (CID 107510864) is [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol is CCN(c1nc(COC)c(CO)s1)C1CCCCC1.
What is the InChIKey of [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is XHFGRCUUOANANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-3-16(11-7-5-4-6-8-11)14-15-12(10-18-2)13(9-17)19-14/h11,17H,3-10H2,1-2H3.
What are the key properties of [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol?
[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 284.42 g/mol, XLogP of 2.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 107510864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).