1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol

C11H14N2O2S — CID 61044455

IUPAC1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol
SMILESCc1csc(CNCC(O)c2ccco2)n1
InChIInChI=1S/C11H14N2O2S/c1-8-7-16-11(13-8)6-12-5-9(14)10-3-2-4-15-10/h2-4,7,9,12,14H,5-6H2,1H3
InChIKeyVLCOXPPTJOTBHD-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.87
Rot. Bonds5

About 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol

1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol (PubChem CID 61044455) has the molecular formula C11H14N2O2S and a molecular weight of 238.31 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol.

Molecular Properties

Compound Name1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol
PubChem CID61044455
Molecular FormulaC11H14N2O2S
Molecular Weight238.31 g/mol
Exact Mass238.08
IUPAC Name1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol
SMILESCc1csc(CNCC(O)c2ccco2)n1
InChIInChI=1S/C11H14N2O2S/c1-8-7-16-11(13-8)6-12-5-9(14)10-3-2-4-15-10/h2-4,7,9,12,14H,5-6H2,1H3
InChIKeyVLCOXPPTJOTBHD-UHFFFAOYSA-N
XLogP1.87
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(furan-2-ylmethoxy)-3-[(4-methyl-1,3-thiazol-2-yl)methylamino]propan-2-ol
CID 54914081
1-[(4-methyl-1,3-thiazol-2-yl)methylamino]propan-2-ol
CID 61044333
1-(furan-2-yl)-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]ethanol
CID 106398102
1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-5-yl)methylamino]ethanol
CID 71982540
1-[(4-methyl-1,3-thiazol-2-yl)methylamino]butan-2-ol
CID 61044334
2-[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]-1-(furan-2-yl)ethanol
CID 106372593
1-(2,4-dichlorophenyl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol
CID 111424572
1-(2-methylphenoxy)-3-[(4-methyl-1,3-thiazol-2-yl)methylamino]propan-2-ol
CID 61042993
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-[1-(4-methyl-1,3-thiazol-2-yl)propyl]urea
CID 111104425
furan-2-yl-(4-methyl-1,3-thiazol-2-yl)methanol
CID 104769449
2-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]butan-1-amine
CID 61043484
1-(furan-2-yl)-1-(1-methylimidazol-2-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine
CID 61044445

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol?
The IUPAC name of 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol (CID 61044455) is 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol.
What is the SMILES notation for 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol?
The canonical SMILES for 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol is Cc1csc(CNCC(O)c2ccco2)n1.
What is the InChIKey of 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol?
The InChIKey is VLCOXPPTJOTBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S/c1-8-7-16-11(13-8)6-12-5-9(14)10-3-2-4-15-10/h2-4,7,9,12,14H,5-6H2,1H3.
What are the key properties of 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol?
1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol has a molecular weight of 238.31 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethanol is sourced from PubChem (CID 61044455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).