[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol

C15H20N2O4 — CID 61497410

IUPAC[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol
SMILESCCOc1cc(CO)ccc1OCc1noc(C(C)C)n1
InChIInChI=1S/C15H20N2O4/c1-4-19-13-7-11(8-18)5-6-12(13)20-9-14-16-15(10(2)3)21-17-14/h5-7,10,18H,4,8-9H2,1-3H3
InChIKeyFDPAJQKJJKPHBS-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.66
Rot. Bonds7

About [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol

[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol (PubChem CID 61497410) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol
PubChem CID61497410
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol
SMILESCCOc1cc(CO)ccc1OCc1noc(C(C)C)n1
InChIInChI=1S/C15H20N2O4/c1-4-19-13-7-11(8-18)5-6-12(13)20-9-14-16-15(10(2)3)21-17-14/h5-7,10,18H,4,8-9H2,1-3H3
InChIKeyFDPAJQKJJKPHBS-UHFFFAOYSA-N
XLogP2.66
TPSA77.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol with MolForge

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Related Compounds

[4-methoxy-3-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanamine
CID 61496889
(1S)-1-[4-methyl-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanol
CID 63650770
3-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]naphthalen-2-ol
CID 61497370
(1R)-1-[2-fluoro-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanol
CID 107719931
1-[3-methoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 61497402
1-[2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 61497359
(1S)-1-[4-bromo-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 102947252
(1S)-1-[4-fluoro-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 78935724
1-[5-methyl-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-2-amine
CID 63325984
5-chloro-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]benzaldehyde
CID 61497406
[3-ethoxy-4-(methoxymethoxy)phenyl]methanol
CID 65364627
4-[[2-ethoxy-4-(hydroxymethyl)phenoxy]methyl]pyridine-2-carbonitrile
CID 63882931

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol?
The IUPAC name of [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol (CID 61497410) is [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol?
The canonical SMILES for [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol is CCOc1cc(CO)ccc1OCc1noc(C(C)C)n1.
What is the InChIKey of [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol?
The InChIKey is FDPAJQKJJKPHBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-4-19-13-7-11(8-18)5-6-12(13)20-9-14-16-15(10(2)3)21-17-14/h5-7,10,18H,4,8-9H2,1-3H3.
What are the key properties of [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol?
[3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol has a molecular weight of 292.34 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 61497410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).