[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol

C17H21NO3 — CID 77083592

IUPAC[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol
SMILESCc1ccc(-c2ccccc2CN2CCOCC2CO)o1
InChIInChI=1S/C17H21NO3/c1-13-6-7-17(21-13)16-5-3-2-4-14(16)10-18-8-9-20-12-15(18)11-19/h2-7,15,19H,8-12H2,1H3
InChIKeyCIKQHAJCZAOGLR-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.45
Rot. Bonds4

About [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol

[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol (PubChem CID 77083592) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol
PubChem CID77083592
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol
SMILESCc1ccc(-c2ccccc2CN2CCOCC2CO)o1
InChIInChI=1S/C17H21NO3/c1-13-6-7-17(21-13)16-5-3-2-4-14(16)10-18-8-9-20-12-15(18)11-19/h2-7,15,19H,8-12H2,1H3
InChIKeyCIKQHAJCZAOGLR-UHFFFAOYSA-N
XLogP2.45
TPSA45.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol with MolForge

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Related Compounds

[4-[(3-chloro-2-fluorophenyl)methyl]morpholin-3-yl]methanol
CID 102858362
[(3S)-4-(2,1,3-benzoxadiazol-4-ylmethyl)morpholin-3-yl]methanol
CID 99936455
[4-[[1-(2,4-difluorophenyl)-3-(2-methylphenyl)pyrazol-4-yl]methyl]morpholin-3-yl]methanol
CID 70757494
[(3R)-4-[(4-methoxyphenyl)methyl]morpholin-3-yl]methanol
CID 163376784
4-[[3-(hydroxymethyl)morpholin-4-yl]methyl]-3-methylbenzenecarbothioamide
CID 114482048
1-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-3-yl]-N-methylmethanamine
CID 104792418
[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol
CID 74232945
1-[[2-(5-methylfuran-2-yl)phenyl]methyl]-3-pyrrolidin-1-ylpiperidine
CID 45223069
N-[[4-[(2,3-difluorophenyl)methyl]morpholin-3-yl]methyl]ethanamine
CID 83099905
N-[[(3S)-1-[[2-(5-methylfuran-2-yl)phenyl]methyl]pyrrolidin-3-yl]methyl]methanesulfonamide
CID 95205463
N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100679
(4-benzylmorpholin-3-yl)methylcarbamic acid
CID 21104643

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol (CID 77083592) is [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol is Cc1ccc(-c2ccccc2CN2CCOCC2CO)o1.
What is the InChIKey of [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol?
The InChIKey is CIKQHAJCZAOGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-13-6-7-17(21-13)16-5-3-2-4-14(16)10-18-8-9-20-12-15(18)11-19/h2-7,15,19H,8-12H2,1H3.
What are the key properties of [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol?
[4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol has a molecular weight of 287.36 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(5-methylfuran-2-yl)phenyl]methyl]morpholin-3-yl]methanol is sourced from PubChem (CID 77083592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).