[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol

C14H24N2O3S — CID 63918393

IUPAC[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
SMILESCOCCN(c1nc(C2CC2)c(CO)s1)C(C)COC
InChIInChI=1S/C14H24N2O3S/c1-10(9-19-3)16(6-7-18-2)14-15-13(11-4-5-11)12(8-17)20-14/h10-11,17H,4-9H2,1-3H3
InChIKeyJSJUPKQHYBDMKX-UHFFFAOYSA-N
MW300.42 g/mol
LogP2.00
Rot. Bonds9

About [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol

[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 63918393) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID63918393
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC Name[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
SMILESCOCCN(c1nc(C2CC2)c(CO)s1)C(C)COC
InChIInChI=1S/C14H24N2O3S/c1-10(9-19-3)16(6-7-18-2)14-15-13(11-4-5-11)12(8-17)20-14/h10-11,17H,4-9H2,1-3H3
InChIKeyJSJUPKQHYBDMKX-UHFFFAOYSA-N
XLogP2.00
TPSA54.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[Cyclopropyl(2,2,2-trifluoroethyl)amino]-4-propyl-1,3-thiazol-5-yl]methanol
CID 55117430
[2-[Propan-2-yl(2,2,2-trifluoroethyl)amino]-4-propyl-1,3-thiazol-5-yl]methanol
CID 62778324
[2-[Ethyl(2,2,2-trifluoroethyl)amino]-4-propyl-1,3-thiazol-5-yl]methanol
CID 62778659
[4-Tert-butyl-2-[cyclopropyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62778661
[4-Propyl-2-[propyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62779329
[2-[Methyl(2,2,2-trifluoroethyl)amino]-4-propyl-1,3-thiazol-5-yl]methanol
CID 62780158
[4-Cyclopropyl-2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 63915464
[4-Cyclopropyl-2-[cyclopropyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 63915465
[4-Cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 63915665
[4-Cyclopropyl-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]-1,3-thiazol-5-yl]methanol
CID 63916658
[4-Cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 63916841
[4-Cyclopropyl-2-[propan-2-yl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
CID 63918389

Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol (CID 63918393) is [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol is COCCN(c1nc(C2CC2)c(CO)s1)C(C)COC.
What is the InChIKey of [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is JSJUPKQHYBDMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-10(9-19-3)16(6-7-18-2)14-15-13(11-4-5-11)12(8-17)20-14/h10-11,17H,4-9H2,1-3H3.
What are the key properties of [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 300.42 g/mol, XLogP of 2.00, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63918393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).