3-ethyl-2-propyloxetan-3-ol

C8H16O2 — CID 22138124

IUPAC3-ethyl-2-propyloxetan-3-ol
SMILESCCCC1OCC1(O)CC
InChIInChI=1S/C8H16O2/c1-3-5-7-8(9,4-2)6-10-7/h7,9H,3-6H2,1-2H3
InChIKeyKVFSVSNDANIWPF-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.33
Rot. Bonds3

About 3-ethyl-2-propyloxetan-3-ol

3-ethyl-2-propyloxetan-3-ol (PubChem CID 22138124) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 3-ethyl-2-propyloxetan-3-ol.

Molecular Properties

Compound Name3-ethyl-2-propyloxetan-3-ol
PubChem CID22138124
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name3-ethyl-2-propyloxetan-3-ol
SMILESCCCC1OCC1(O)CC
InChIInChI=1S/C8H16O2/c1-3-5-7-8(9,4-2)6-10-7/h7,9H,3-6H2,1-2H3
InChIKeyKVFSVSNDANIWPF-UHFFFAOYSA-N
XLogP1.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethyl-3-propyloxiran-2-yl)-4-methyl-1,3-dioxolane
CID 121222566
[(2S,3R)-2-methyl-3-propyloxiran-2-yl]methanol
CID 14959485
4-ethyl-2-propyl-3a,5,6,6a-tetrahydrocyclopenta[d][1,3]dioxol-4-ol
CID 73011386
(3S,3aS,4S,6aR)-3-propyl-3,3a,4,6-tetrahydro-1H-furo[3,4-c]furan-4,6a-diol
CID 101357742
5-ethyl-2-propyl-1,3-dioxane-5-carboxylic acid
CID 14047275
(2R)-2-(hydroxymethyl)oxolane-3,3,4,4-tetrol
CID 173354418
(4R,5S)-5-chloro-4-methyl-2-propyloxan-4-ol
CID 130765140
2-[(2,2-dimethyl-3-propylcyclopropyl)methyl]-1,3-dioxolane
CID 71384764
3-propylcyclobutane-1,1-diol
CID 18328679
(3S,3aR,6R,6aR)-3,6-dipropyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 59336408
(6aR)-3,6-dipropyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 137382626
cis-(1S,2R)-1-ethylcyclobutane-1,2-diol
CID 102159302

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-propyloxetan-3-ol?
The IUPAC name of 3-ethyl-2-propyloxetan-3-ol (CID 22138124) is 3-ethyl-2-propyloxetan-3-ol.
What is the SMILES notation for 3-ethyl-2-propyloxetan-3-ol?
The canonical SMILES for 3-ethyl-2-propyloxetan-3-ol is CCCC1OCC1(O)CC.
What is the InChIKey of 3-ethyl-2-propyloxetan-3-ol?
The InChIKey is KVFSVSNDANIWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-3-5-7-8(9,4-2)6-10-7/h7,9H,3-6H2,1-2H3.
What are the key properties of 3-ethyl-2-propyloxetan-3-ol?
3-ethyl-2-propyloxetan-3-ol has a molecular weight of 144.21 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-propyloxetan-3-ol is sourced from PubChem (CID 22138124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).