1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol

C14H20O4 — CID 117384091

IUPAC1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol
SMILESCOc1cc(C2(O)CC2)c(OC)cc1OC(C)C
InChIInChI=1S/C14H20O4/c1-9(2)18-13-8-11(16-3)10(7-12(13)17-4)14(15)5-6-14/h7-9,15H,5-6H2,1-4H3
InChIKeyISADWEKLYUQCOW-UHFFFAOYSA-N
MW252.31 g/mol
LogP2.47
Rot. Bonds5

About 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol

1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol (PubChem CID 117384091) has the molecular formula C14H20O4 and a molecular weight of 252.31 g/mol. Its IUPAC name is 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol
PubChem CID117384091
Molecular FormulaC14H20O4
Molecular Weight252.31 g/mol
Exact Mass252.14
IUPAC Name1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol
SMILESCOc1cc(C2(O)CC2)c(OC)cc1OC(C)C
InChIInChI=1S/C14H20O4/c1-9(2)18-13-8-11(16-3)10(7-12(13)17-4)14(15)5-6-14/h7-9,15H,5-6H2,1-4H3
InChIKeyISADWEKLYUQCOW-UHFFFAOYSA-N
XLogP2.47
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-amine
CID 117381647
1-(5-ethoxy-2,4-dimethoxyphenyl)cyclopropan-1-ol
CID 117349200
[1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopentyl]methanamine
CID 117473584
1-(2-bromo-4,5-dimethoxyphenyl)cyclopropan-1-ol
CID 117435002
5-(1-hydroxycyclopropyl)-2,4-dimethoxybenzoic acid
CID 117348722
1-[1-(2-chloro-5-methoxy-4-propan-2-yloxyphenyl)cyclopropyl]ethanamine
CID 117456418
1-[2-(2-fluoropropan-2-yl)-4,5-dimethoxyphenyl]cyclopropan-1-ol
CID 117389108
1-(2-methoxy-4-methylphenyl)cyclopropan-1-ol
CID 117277830
1-(4-bromo-5-fluoro-2-methoxyphenyl)cyclopropan-1-ol
CID 84806667
1,2-diiodo-4-methoxy-5-propan-2-yloxybenzene
CID 11189277
1-(2-chloro-3-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
CID 117354231
1-(4-fluoro-5-methoxy-2-methylphenyl)cyclopropan-1-ol
CID 84773917

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol (CID 117384091) is 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol is COc1cc(C2(O)CC2)c(OC)cc1OC(C)C.
What is the InChIKey of 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol?
The InChIKey is ISADWEKLYUQCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O4/c1-9(2)18-13-8-11(16-3)10(7-12(13)17-4)14(15)5-6-14/h7-9,15H,5-6H2,1-4H3.
What are the key properties of 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol?
1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol has a molecular weight of 252.31 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117384091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).