1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol

C11H20O2 — CID 103560172

IUPAC1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol
SMILESC=C(C)CC(O)CC1(OC)CCC1
InChIInChI=1S/C11H20O2/c1-9(2)7-10(12)8-11(13-3)5-4-6-11/h10,12H,1,4-8H2,2-3H3
InChIKeySITVZWWWGODVBT-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.27
Rot. Bonds5

About 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol

1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol (PubChem CID 103560172) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol
PubChem CID103560172
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol
SMILESC=C(C)CC(O)CC1(OC)CCC1
InChIInChI=1S/C11H20O2/c1-9(2)7-10(12)8-11(13-3)5-4-6-11/h10,12H,1,4-8H2,2-3H3
InChIKeySITVZWWWGODVBT-UHFFFAOYSA-N
XLogP2.27
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(1-methoxycyclobutyl)-4-methyl-N-propylpent-4-en-2-amine
CID 103559545
1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol
CID 103560182
N-ethyl-1-(1-methoxycyclobutyl)-3-methylbut-3-en-2-amine
CID 103559552
1-(1-methoxycyclopentyl)-3-methylbut-3-en-1-ol
CID 104610434
1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol
CID 103560276
1-(1-methoxycyclobutyl)-3-methylbut-3-en-1-amine
CID 116713908
1-(1-methoxycyclobutyl)-5-methyl-N-propylhex-5-en-2-amine
CID 103559831
1-(4-chlorophenyl)-2-(1-methoxycyclobutyl)ethanol
CID 103557502
1-(1-methoxycyclobutyl)-5-methylhex-5-en-2-one
CID 103558952
1-(2-chloro-3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-ol
CID 103560237
1-(1-methoxycyclobutyl)-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107065829
(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol
CID 134964814

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol?
The IUPAC name of 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol (CID 103560172) is 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol.
What is the SMILES notation for 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol?
The canonical SMILES for 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol is C=C(C)CC(O)CC1(OC)CCC1.
What is the InChIKey of 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol?
The InChIKey is SITVZWWWGODVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-9(2)7-10(12)8-11(13-3)5-4-6-11/h10,12H,1,4-8H2,2-3H3.
What are the key properties of 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol?
1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol has a molecular weight of 184.28 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-ol is sourced from PubChem (CID 103560172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).