[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol

C14H18O2 — CID 142337656

IUPAC[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol
SMILESCOc1cccc(C2=CCC(CO)CC2)c1
InChIInChI=1S/C14H18O2/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12/h2-4,7,9,11,15H,5-6,8,10H2,1H3
InChIKeyDCFUFWBRNDTJNC-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.87
Rot. Bonds3

About [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol

[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol (PubChem CID 142337656) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol.

Molecular Properties

Compound Name[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol
PubChem CID142337656
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol
SMILESCOc1cccc(C2=CCC(CO)CC2)c1
InChIInChI=1S/C14H18O2/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12/h2-4,7,9,11,15H,5-6,8,10H2,1H3
InChIKeyDCFUFWBRNDTJNC-UHFFFAOYSA-N
XLogP2.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 67868072
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CID 117148171
[(1S,3S)-3-(3-methoxyphenyl)cyclopentyl]methanol
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4-(3-methoxyphenyl)-1,2,3,6-tetrahydropyridine;hydrochloride
CID 21289058
[5-(3-methoxyphenyl)-1-methylpyrrolidin-3-yl]methanol
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5-(3-methoxyphenyl)-2,3,4,7-tetrahydro-1H-azepine
CID 71262155
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
(2Z)-4-(hydroxymethyl)-2-[(3-methoxyphenyl)methylidene]cyclohexan-1-one
CID 68642810
1-methoxy-4-(4-methylcyclohexen-1-yl)benzene
CID 3765590
[(2R,3S)-3-(3-methoxyphenyl)pyrrolidin-2-yl]methanol
CID 131873349
4-(3-methoxyphenyl)-N-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)cyclohex-3-ene-1-carboxamide
CID 175436481

Frequently Asked Questions

What is the IUPAC name of [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol?
The IUPAC name of [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol (CID 142337656) is [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol.
What is the SMILES notation for [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol?
The canonical SMILES for [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol is COc1cccc(C2=CCC(CO)CC2)c1.
What is the InChIKey of [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol?
The InChIKey is DCFUFWBRNDTJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12/h2-4,7,9,11,15H,5-6,8,10H2,1H3.
What are the key properties of [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol?
[4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol has a molecular weight of 218.30 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methoxyphenyl)cyclohex-3-en-1-yl]methanol is sourced from PubChem (CID 142337656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).