[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol

C12H14O2 — CID 155898884

IUPAC[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol
SMILESCc1ccc(C2(CO)C=CC=CC2)o1
InChIInChI=1S/C12H14O2/c1-10-5-6-11(14-10)12(9-13)7-3-2-4-8-12/h2-7,13H,8-9H2,1H3
InChIKeyFZOWNTQTZCITQS-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.33
Rot. Bonds2

About [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol

[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol (PubChem CID 155898884) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol.

Molecular Properties

Compound Name[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol
PubChem CID155898884
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol
SMILESCc1ccc(C2(CO)C=CC=CC2)o1
InChIInChI=1S/C12H14O2/c1-10-5-6-11(14-10)12(9-13)7-3-2-4-8-12/h2-7,13H,8-9H2,1H3
InChIKeyFZOWNTQTZCITQS-UHFFFAOYSA-N
XLogP2.33
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Ipomeanol
CID 36284
3-(5-Methyl-2-furyl)butanal
CID 3578033
3-Furanmethanol, 5-(phenylmethyl)-
CID 12364396
Furan, 2,2'-(1-methylethylidene)bis-
CID 595339
2-tert-Butylfuran
CID 138903
(E)-6-Methyl-6-(5-methyl-2-furanyl)-3-hepten-2-one
CID 21767560
2-[5-(4-Chlorophenyl)-2-furyl]ethanol
CID 745896
2-(3-Phenylpropyl)furan
CID 529780
1-(2-Furanyl)-2-butanone
CID 546033
Rose furan epoxide
CID 6428926
1-(5-Methyl-2-furyl)-2-propanone
CID 6429113
5-(3-Furanyl)-5-hydroxy-2-pentanone
CID 161819

Frequently Asked Questions

What is the IUPAC name of [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol?
The IUPAC name of [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol (CID 155898884) is [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol.
What is the SMILES notation for [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol?
The canonical SMILES for [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol is Cc1ccc(C2(CO)C=CC=CC2)o1.
What is the InChIKey of [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol?
The InChIKey is FZOWNTQTZCITQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-10-5-6-11(14-10)12(9-13)7-3-2-4-8-12/h2-7,13H,8-9H2,1H3.
What are the key properties of [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol?
[1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol has a molecular weight of 190.24 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methylfuran-2-yl)cyclohexa-2,4-dien-1-yl]methanol is sourced from PubChem (CID 155898884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).