(2R)-1-propan-2-yloxypent-4-en-2-ol

C8H16O2 — CID 130127578

IUPAC(2R)-1-propan-2-yloxypent-4-en-2-ol
SMILESC=CC[C@@H](O)COC(C)C
InChIInChI=1S/C8H16O2/c1-4-5-8(9)6-10-7(2)3/h4,7-9H,1,5-6H2,2-3H3/t8-/m1/s1
InChIKeyHVTLPRUSDJUNCT-MRVPVSSYSA-N
MW144.21 g/mol
LogP1.35
Rot. Bonds5

About (2R)-1-propan-2-yloxypent-4-en-2-ol

(2R)-1-propan-2-yloxypent-4-en-2-ol (PubChem CID 130127578) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (2R)-1-propan-2-yloxypent-4-en-2-ol.

Molecular Properties

Compound Name(2R)-1-propan-2-yloxypent-4-en-2-ol
PubChem CID130127578
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(2R)-1-propan-2-yloxypent-4-en-2-ol
SMILESC=CC[C@@H](O)COC(C)C
InChIInChI=1S/C8H16O2/c1-4-5-8(9)6-10-7(2)3/h4,7-9H,1,5-6H2,2-3H3/t8-/m1/s1
InChIKeyHVTLPRUSDJUNCT-MRVPVSSYSA-N
XLogP1.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.35
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-propan-2-yloxy-4-prop-2-enoxypentan-2-ol
CID 138664594
4-methyl-5-propan-2-yloxypent-1-ene
CID 144799299
1-propan-2-yloxyhept-6-en-2-ol
CID 105102103
(2R)-1-fluoro-3-propan-2-yloxypropan-2-ol
CID 158358225
N-methyl-1-propan-2-yloxypent-4-en-2-amine
CID 116660601
(3S)-hex-5-en-3-ol
CID 10749148
hex-5-en-3-ol
CID 158321330
(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
CID 11148647
(2R)-1-[[(2R)-2-hydroxy-3-propan-2-yloxypropyl]amino]-3-propan-2-yloxypropan-2-ol
CID 38999921
1-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxypent-4-en-2-ol
CID 10955810
azane;pent-4-en-2-ol
CID 22149561
1-methoxy-2-methylhex-5-en-3-ol
CID 116502507

Frequently Asked Questions

What is the IUPAC name of (2R)-1-propan-2-yloxypent-4-en-2-ol?
The IUPAC name of (2R)-1-propan-2-yloxypent-4-en-2-ol (CID 130127578) is (2R)-1-propan-2-yloxypent-4-en-2-ol.
What is the SMILES notation for (2R)-1-propan-2-yloxypent-4-en-2-ol?
The canonical SMILES for (2R)-1-propan-2-yloxypent-4-en-2-ol is C=CC[C@@H](O)COC(C)C.
What is the InChIKey of (2R)-1-propan-2-yloxypent-4-en-2-ol?
The InChIKey is HVTLPRUSDJUNCT-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H16O2/c1-4-5-8(9)6-10-7(2)3/h4,7-9H,1,5-6H2,2-3H3/t8-/m1/s1.
What are the key properties of (2R)-1-propan-2-yloxypent-4-en-2-ol?
(2R)-1-propan-2-yloxypent-4-en-2-ol has a molecular weight of 144.21 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-propan-2-yloxypent-4-en-2-ol is sourced from PubChem (CID 130127578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).