[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol

C11H16O2 — CID 169243429

IUPAC[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol
SMILESC=C(CC(C)C)c1ccc(CO)o1
InChIInChI=1S/C11H16O2/c1-8(2)6-9(3)11-5-4-10(7-12)13-11/h4-5,8,12H,3,6-7H2,1-2H3
InChIKeyIXYLKCOEQJBYSK-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.83
Rot. Bonds4

About [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol

[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol (PubChem CID 169243429) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol
PubChem CID169243429
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol
SMILESC=C(CC(C)C)c1ccc(CO)o1
InChIInChI=1S/C11H16O2/c1-8(2)6-9(3)11-5-4-10(7-12)13-11/h4-5,8,12H,3,6-7H2,1-2H3
InChIKeyIXYLKCOEQJBYSK-UHFFFAOYSA-N
XLogP2.83
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-prop-1-en-2-ylfuran-2-yl)methanol
CID 119081817
2,3-dihydroxy-1-[5-(hydroxymethyl)furan-2-yl]butan-1-one
CID 123406498
1-[5-(hydroxymethyl)furan-2-yl]ethenyl 2-methylprop-2-enoate
CID 67891886
2-hydroxy-1-[5-(hydroxymethyl)furan-2-yl]ethanone
CID 91750740
[5-(2-aminobutyl)furan-2-yl]methanol
CID 170888411
[5-[(2-methylpropoxyamino)methyl]furan-2-yl]methanol
CID 82709928
(1R,2S)-1-amino-1-[5-(hydroxymethyl)furan-2-yl]propan-2-ol
CID 130739101
azane;(5-methylfuran-2-yl)methanol
CID 175565780
[5-(hydroxymethyl)furan-2-yl]methanol;bis(6-methylheptanoic acid)
CID 118471758
[5-(4-ethylphenyl)furan-2-yl]methanol
CID 60894732
[4-[5-(hydroxymethyl)furan-2-yl]phenyl]methanol
CID 163843794
[5-[1-(1-methoxyethoxy)ethyl]furan-2-yl]methanol
CID 121368855

Frequently Asked Questions

What is the IUPAC name of [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol?
The IUPAC name of [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol (CID 169243429) is [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol.
What is the SMILES notation for [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol?
The canonical SMILES for [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol is C=C(CC(C)C)c1ccc(CO)o1.
What is the InChIKey of [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol?
The InChIKey is IXYLKCOEQJBYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-8(2)6-9(3)11-5-4-10(7-12)13-11/h4-5,8,12H,3,6-7H2,1-2H3.
What are the key properties of [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol?
[5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol has a molecular weight of 180.25 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-methylpent-1-en-2-yl)furan-2-yl]methanol is sourced from PubChem (CID 169243429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).