(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol

C14H20O2 — CID 66751010

IUPAC(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol
SMILESC=Cc1cc(OC)ccc1C[C@@H](CC)CO
InChIInChI=1S/C14H20O2/c1-4-11(10-15)8-13-6-7-14(16-3)9-12(13)5-2/h5-7,9,11,15H,2,4,8,10H2,1,3H3/t11-/m1/s1
InChIKeySRXJAYSOKFHCGW-LLVKDONJSA-N
MW220.31 g/mol
LogP2.90
Rot. Bonds6

About (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol

(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol (PubChem CID 66751010) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol
PubChem CID66751010
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol
SMILESC=Cc1cc(OC)ccc1C[C@@H](CC)CO
InChIInChI=1S/C14H20O2/c1-4-11(10-15)8-13-6-7-14(16-3)9-12(13)5-2/h5-7,9,11,15H,2,4,8,10H2,1,3H3/t11-/m1/s1
InChIKeySRXJAYSOKFHCGW-LLVKDONJSA-N
XLogP2.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butanal
CID 86624017
2-[(2,5-dimethoxyphenyl)methyl]butan-1-ol
CID 116930738
1-ethenyl-2-(2-ethylbutyl)benzene
CID 22475782
2-[(2,3-dichloro-4-methoxyphenyl)methyl]butan-1-ol
CID 116930825
2-[(2-ethenyl-5-methoxyphenyl)methyl-methylamino]ethanol
CID 15154905
2-ethenyl-4-methoxy-1-(2-propylpentoxy)benzene
CID 174257896
2-ethenyl-4-methoxy-1-(trifluoromethyl)benzene
CID 167531102
2-[(2-methoxy-5-propan-2-ylphenyl)methyl]butan-1-ol
CID 116930752
2-(3-chlorobutyl)-1-ethenyl-4-methoxybenzene
CID 66808234
1-ethenyl-2-(3-iodopropyl)-4-methoxybenzene
CID 66808178
2-ethyl-4-methoxy-1-(2-methylbut-3-enyl)benzene
CID 83941599
2-[(4-methoxyphenyl)methyl]propane-1,3-diol
CID 11008852

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol?
The IUPAC name of (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol (CID 66751010) is (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol.
What is the SMILES notation for (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol?
The canonical SMILES for (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol is C=Cc1cc(OC)ccc1C[C@@H](CC)CO.
What is the InChIKey of (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol?
The InChIKey is SRXJAYSOKFHCGW-LLVKDONJSA-N. The full InChI is InChI=1S/C14H20O2/c1-4-11(10-15)8-13-6-7-14(16-3)9-12(13)5-2/h5-7,9,11,15H,2,4,8,10H2,1,3H3/t11-/m1/s1.
What are the key properties of (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol?
(2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol has a molecular weight of 220.31 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2-ethenyl-4-methoxyphenyl)methyl]butan-1-ol is sourced from PubChem (CID 66751010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).