3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol

C11H14O3 — CID 117284575

IUPAC3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol
SMILESCOc1ccc(O)cc1CC1(O)CC1
InChIInChI=1S/C11H14O3/c1-14-10-3-2-9(12)6-8(10)7-11(13)4-5-11/h2-3,6,12-13H,4-5,7H2,1H3
InChIKeyFQXQHIUEWFWBBD-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.47
Rot. Bonds3

About 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol

3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol (PubChem CID 117284575) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol.

Molecular Properties

Compound Name3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol
PubChem CID117284575
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol
SMILESCOc1ccc(O)cc1CC1(O)CC1
InChIInChI=1S/C11H14O3/c1-14-10-3-2-9(12)6-8(10)7-11(13)4-5-11/h2-3,6,12-13H,4-5,7H2,1H3
InChIKeyFQXQHIUEWFWBBD-UHFFFAOYSA-N
XLogP1.47
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-methoxy-5-methylphenyl)methyl]cyclopentan-1-ol
CID 62161336
1-[(2,3,4-trimethoxyphenyl)methyl]cyclopropan-1-ol
CID 117349180
4-tert-butyl-1-[(2-methoxy-5-methylphenyl)methyl]cyclohexan-1-ol
CID 63406908
4-fluoro-2-[(1-hydroxycyclopropyl)methyl]-6-methoxyphenol
CID 117302776
4-[(5-chloro-2-methoxyphenyl)methyl]-1-methylpiperidin-4-ol
CID 65146901
1-[[3,6-dimethoxy-2-(methoxymethyl)phenyl]methyl]cyclopropan-1-ol
CID 117384074
1-ethyl-4-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-ol
CID 62161513
3-ethyl-2-[(1-hydroxycyclopropyl)methyl]-6-methoxyphenol
CID 117318322
1-[(2-bromo-3,4-dimethoxyphenyl)methyl]cyclopropan-1-ol
CID 117462934
4-methoxy-3-(methylaminomethyl)phenol
CID 84731678
3-[(5-fluoro-2-methoxyphenyl)methyl]azetidin-3-ol
CID 83688912
3-[(5-bromo-2-methoxyphenyl)methyl]thiolan-3-ol
CID 79950148

Frequently Asked Questions

What is the IUPAC name of 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol?
The IUPAC name of 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol (CID 117284575) is 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol.
What is the SMILES notation for 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol?
The canonical SMILES for 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol is COc1ccc(O)cc1CC1(O)CC1.
What is the InChIKey of 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol?
The InChIKey is FQXQHIUEWFWBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-14-10-3-2-9(12)6-8(10)7-11(13)4-5-11/h2-3,6,12-13H,4-5,7H2,1H3.
What are the key properties of 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol?
3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol has a molecular weight of 194.23 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol is sourced from PubChem (CID 117284575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).