(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol

C15H18O3S — CID 115833017

IUPAC(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol
SMILESCCCOc1ccccc1C(O)c1sccc1OC
InChIInChI=1S/C15H18O3S/c1-3-9-18-12-7-5-4-6-11(12)14(16)15-13(17-2)8-10-19-15/h4-8,10,14,16H,3,9H2,1-2H3
InChIKeyFMIBPCZIESKICZ-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.63
Rot. Bonds6

About (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol

(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol (PubChem CID 115833017) has the molecular formula C15H18O3S and a molecular weight of 278.37 g/mol. Its IUPAC name is (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol.

Molecular Properties

Compound Name(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol
PubChem CID115833017
Molecular FormulaC15H18O3S
Molecular Weight278.37 g/mol
Exact Mass278.10
IUPAC Name(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol
SMILESCCCOc1ccccc1C(O)c1sccc1OC
InChIInChI=1S/C15H18O3S/c1-3-9-18-12-7-5-4-6-11(12)14(16)15-13(17-2)8-10-19-15/h4-8,10,14,16H,3,9H2,1-2H3
InChIKeyFMIBPCZIESKICZ-UHFFFAOYSA-N
XLogP3.63
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-propoxyphenyl)-(1,3-thiazol-2-yl)methanol
CID 104658962
(3-bromothiophen-2-yl)-[2-(2-methoxyethoxy)phenyl]methanol
CID 104658901
(4-chloro-2-methoxyphenyl)-(2-propoxyphenyl)methanol
CID 115833005
(2-methoxy-3-pyridinyl)-(2-propoxyphenyl)methanol
CID 105125991
(3-bromo-4-methoxyphenyl)-(2-propoxyphenyl)methanol
CID 104658559
1-[2-(2-methoxyethoxy)phenyl]-1-(3-methoxythiophen-2-yl)-N-methylmethanamine
CID 105035272
1-(2-propoxyphenyl)ethanol
CID 43503976
1-benzothiophen-3-yl-(2-propoxyphenyl)methanol
CID 104658650
(4-iodophenyl)-(2-propoxyphenyl)methanol
CID 115833070
[2-(2-methoxyethoxy)phenyl]-(4-methyl-1,3-thiazol-5-yl)methanol
CID 105125520
(3-methoxythiophen-2-yl)-(3-propylphenyl)methanol
CID 115838098
(2-methoxyphenyl)-(3-propoxyphenyl)methanol
CID 63894602

Frequently Asked Questions

What is the IUPAC name of (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol?
The IUPAC name of (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol (CID 115833017) is (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol.
What is the SMILES notation for (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol?
The canonical SMILES for (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol is CCCOc1ccccc1C(O)c1sccc1OC.
What is the InChIKey of (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol?
The InChIKey is FMIBPCZIESKICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3S/c1-3-9-18-12-7-5-4-6-11(12)14(16)15-13(17-2)8-10-19-15/h4-8,10,14,16H,3,9H2,1-2H3.
What are the key properties of (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol?
(3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol has a molecular weight of 278.37 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxythiophen-2-yl)-(2-propoxyphenyl)methanol is sourced from PubChem (CID 115833017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).