2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol

C18H23NO3S — CID 99936738

IUPAC2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol
SMILESCc1ccc(Sc2ccc(CN3CCO[C@H](CCO)C3)o2)cc1
InChIInChI=1S/C18H23NO3S/c1-14-2-5-17(6-3-14)23-18-7-4-16(22-18)13-19-9-11-21-15(12-19)8-10-20/h2-7,15,20H,8-13H2,1H3/t15-/m1/s1
InChIKeyQFTXXZOJOSXMMU-OAHLLOKOSA-N
MW333.45 g/mol
LogP3.32
Rot. Bonds6

About 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol

2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol (PubChem CID 99936738) has the molecular formula C18H23NO3S and a molecular weight of 333.45 g/mol. Its IUPAC name is 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol.

Molecular Properties

Compound Name2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol
PubChem CID99936738
Molecular FormulaC18H23NO3S
Molecular Weight333.45 g/mol
Exact Mass333.14
IUPAC Name2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol
SMILESCc1ccc(Sc2ccc(CN3CCO[C@H](CCO)C3)o2)cc1
InChIInChI=1S/C18H23NO3S/c1-14-2-5-17(6-3-14)23-18-7-4-16(22-18)13-19-9-11-21-15(12-19)8-10-20/h2-7,15,20H,8-13H2,1H3/t15-/m1/s1
InChIKeyQFTXXZOJOSXMMU-OAHLLOKOSA-N
XLogP3.32
TPSA45.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.45
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol with MolForge

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Related Compounds

(2S)-N-cyclopropyl-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]piperazine-2-carboxamide
CID 95722154
2-[4-[(4-methylphenyl)methyl]morpholin-2-yl]acetic acid
CID 66433866
4-[(5-bromofuran-2-yl)methyl]-2-(bromomethyl)morpholine
CID 131047863
[5-[[(2S)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]methyl]furan-2-yl]methanol
CID 129344343
2-[(2S)-4-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]morpholin-2-yl]ethanol
CID 95394340
methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate
CID 79827347
3-(4-benzylmorpholin-2-yl)propan-1-ol
CID 23079673
[5-[[4-(4-methylphenyl)sulfanylpiperidin-1-yl]methyl]furan-2-yl]methanol
CID 50966552
2-[(2R)-4-[[5-methyl-2-[3-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl]methyl]morpholin-2-yl]ethanol
CID 95202746
2-[4-[(3-chloro-5-fluorophenyl)methyl]morpholin-2-yl]ethanol
CID 77087045
methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate
CID 97159681
2-[4-[(2,5-dimethylphenyl)methyl]morpholin-2-yl]acetic acid
CID 66433908

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol?
The IUPAC name of 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol (CID 99936738) is 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol.
What is the SMILES notation for 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol?
The canonical SMILES for 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol is Cc1ccc(Sc2ccc(CN3CCO[C@H](CCO)C3)o2)cc1.
What is the InChIKey of 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol?
The InChIKey is QFTXXZOJOSXMMU-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H23NO3S/c1-14-2-5-17(6-3-14)23-18-7-4-16(22-18)13-19-9-11-21-15(12-19)8-10-20/h2-7,15,20H,8-13H2,1H3/t15-/m1/s1.
What are the key properties of 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol?
2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol has a molecular weight of 333.45 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methyl]morpholin-2-yl]ethanol is sourced from PubChem (CID 99936738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).