(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol

C11H22O3 — CID 12892311

IUPAC(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol
SMILESC[C@H](CCO)CCOC1CCCCO1
InChIInChI=1S/C11H22O3/c1-10(5-7-12)6-9-14-11-4-2-3-8-13-11/h10-12H,2-9H2,1H3/t10-,11?/m1/s1
InChIKeyBTXXIVQNWRJRLA-NFJWQWPMSA-N
MW202.29 g/mol
LogP1.94
Rot. Bonds6

About (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol

(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol (PubChem CID 12892311) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol.

Molecular Properties

Compound Name(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol
PubChem CID12892311
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol
SMILESC[C@H](CCO)CCOC1CCCCO1
InChIInChI=1S/C11H22O3/c1-10(5-7-12)6-9-14-11-4-2-3-8-13-11/h10-12H,2-9H2,1H3/t10-,11?/m1/s1
InChIKeyBTXXIVQNWRJRLA-NFJWQWPMSA-N
XLogP1.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol?
The IUPAC name of (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol (CID 12892311) is (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol.
What is the SMILES notation for (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol?
The canonical SMILES for (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol is C[C@H](CCO)CCOC1CCCCO1.
What is the InChIKey of (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol?
The InChIKey is BTXXIVQNWRJRLA-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H22O3/c1-10(5-7-12)6-9-14-11-4-2-3-8-13-11/h10-12H,2-9H2,1H3/t10-,11?/m1/s1.
What are the key properties of (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol?
(3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol has a molecular weight of 202.29 g/mol, XLogP of 1.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-5-(oxan-2-yloxy)pentan-1-ol is sourced from PubChem (CID 12892311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).