(2R,4R)-1,2,3,4,5-pentamethoxypentane

C10H22O5 — CID 90327969

IUPAC(2R,4R)-1,2,3,4,5-pentamethoxypentane
SMILESCOC[C@@H](OC)C(OC)[C@@H](COC)OC
InChIInChI=1S/C10H22O5/c1-11-6-8(13-3)10(15-5)9(14-4)7-12-2/h8-10H,6-7H2,1-5H3/t8-,9-/m1/s1
InChIKeyUKACKIRJWDAFEZ-RKDXNWHRSA-N
MW222.28 g/mol
LogP0.32
Rot. Bonds9

About (2R,4R)-1,2,3,4,5-pentamethoxypentane

(2R,4R)-1,2,3,4,5-pentamethoxypentane (PubChem CID 90327969) has the molecular formula C10H22O5 and a molecular weight of 222.28 g/mol. Its IUPAC name is (2R,4R)-1,2,3,4,5-pentamethoxypentane.

Molecular Properties

Compound Name(2R,4R)-1,2,3,4,5-pentamethoxypentane
PubChem CID90327969
Molecular FormulaC10H22O5
Molecular Weight222.28 g/mol
Exact Mass222.15
IUPAC Name(2R,4R)-1,2,3,4,5-pentamethoxypentane
SMILESCOC[C@@H](OC)C(OC)[C@@H](COC)OC
InChIInChI=1S/C10H22O5/c1-11-6-8(13-3)10(15-5)9(14-4)7-12-2/h8-10H,6-7H2,1-5H3/t8-,9-/m1/s1
InChIKeyUKACKIRJWDAFEZ-RKDXNWHRSA-N
XLogP0.32
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1,2,3-trimethoxy-4-methylpentane
CID 23384640
1,2,3,4,5-pentamethoxyhexane
CID 529418
(2R,3R,4S,5S)-1,2,4,5,6-pentamethoxyhexan-3-ol
CID 15689262
(3R,4R,5S)-1,2,3,4,6-pentamethoxy-5-propan-2-yloxyhexane
CID 88544683
1,2,3,4,5-pentamethoxy-6-propan-2-yloxyhexane
CID 123753623
methyl 2,4,5,6,7-pentamethoxyheptanoate
CID 582206
(3S)-1,2,3-trimethoxypentane
CID 167509153
CID 59269731
CID 59269731
(2R,3S,4S,5R)-2,4-dihydroxy-3,5,6-trimethoxyhexanoic acid
CID 25209635
(2,4-diacetyloxy-3,5-dimethoxypentyl) acetate
CID 539466
1,3,5-trimethoxypentane-2,4-diamine
CID 88989163
(2R,3S,4R,5R)-4-hydroxy-2,3,5,6-tetramethoxyhexanamide
CID 54343689

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-1,2,3,4,5-pentamethoxypentane?
The IUPAC name of (2R,4R)-1,2,3,4,5-pentamethoxypentane (CID 90327969) is (2R,4R)-1,2,3,4,5-pentamethoxypentane.
What is the SMILES notation for (2R,4R)-1,2,3,4,5-pentamethoxypentane?
The canonical SMILES for (2R,4R)-1,2,3,4,5-pentamethoxypentane is COC[C@@H](OC)C(OC)[C@@H](COC)OC.
What is the InChIKey of (2R,4R)-1,2,3,4,5-pentamethoxypentane?
The InChIKey is UKACKIRJWDAFEZ-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H22O5/c1-11-6-8(13-3)10(15-5)9(14-4)7-12-2/h8-10H,6-7H2,1-5H3/t8-,9-/m1/s1.
What are the key properties of (2R,4R)-1,2,3,4,5-pentamethoxypentane?
(2R,4R)-1,2,3,4,5-pentamethoxypentane has a molecular weight of 222.28 g/mol, XLogP of 0.32, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-1,2,3,4,5-pentamethoxypentane is sourced from PubChem (CID 90327969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).