(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol

C15H18O3S — CID 115824055

IUPAC(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol
SMILESCOc1ccsc1C(O)c1cccc(OC(C)C)c1
InChIInChI=1S/C15H18O3S/c1-10(2)18-12-6-4-5-11(9-12)14(16)15-13(17-3)7-8-19-15/h4-10,14,16H,1-3H3
InChIKeyHYNINPPCIVYOBN-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.63
Rot. Bonds5

About (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol

(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol (PubChem CID 115824055) has the molecular formula C15H18O3S and a molecular weight of 278.37 g/mol. Its IUPAC name is (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol
PubChem CID115824055
Molecular FormulaC15H18O3S
Molecular Weight278.37 g/mol
Exact Mass278.10
IUPAC Name(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol
SMILESCOc1ccsc1C(O)c1cccc(OC(C)C)c1
InChIInChI=1S/C15H18O3S/c1-10(2)18-12-6-4-5-11(9-12)14(16)15-13(17-3)7-8-19-15/h4-10,14,16H,1-3H3
InChIKeyHYNINPPCIVYOBN-UHFFFAOYSA-N
XLogP3.63
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
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

(3-methoxythiophen-2-yl)-(3-propylphenyl)methanol
CID 115838098
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(4-bromo-2-methoxyphenyl)-(3-propan-2-yloxyphenyl)methanol
CID 115824010
(4-aminophenyl)-(3-propan-2-yloxyphenyl)methanol
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(1S)-1-(3-propan-2-yloxyphenyl)ethanol
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(3-ethylthiophen-2-yl)-(3-propan-2-yloxyphenyl)methanamine
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(3-chlorophenyl)-(3-propan-2-yloxyphenyl)methanol
CID 63895368
(3-propan-2-yloxyphenyl)-(4-propylthiadiazol-5-yl)methanol
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2-[hydroxy-(4-propan-2-yloxyphenyl)methyl]thiophene-3-carboxylic acid
CID 107432058
(3-propan-2-yloxyphenyl)-(4-propylphenyl)methanol
CID 62919489
3-methyl-1-(3-propan-2-yloxyphenyl)butane-1,2-diol
CID 103456619
(5-methylfuran-2-yl)-(3-propan-2-yloxyphenyl)methanol
CID 79020840

Frequently Asked Questions

What is the IUPAC name of (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol?
The IUPAC name of (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol (CID 115824055) is (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol is COc1ccsc1C(O)c1cccc(OC(C)C)c1.
What is the InChIKey of (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol?
The InChIKey is HYNINPPCIVYOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3S/c1-10(2)18-12-6-4-5-11(9-12)14(16)15-13(17-3)7-8-19-15/h4-10,14,16H,1-3H3.
What are the key properties of (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol?
(3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol has a molecular weight of 278.37 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxythiophen-2-yl)-(3-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 115824055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).