2-pentoxy-3,4-dihydro-2H-pyran

C10H18O2 — CID 67741982

IUPAC2-pentoxy-3,4-dihydro-2H-pyran
SMILESCCCCCOC1CCC=CO1
InChIInChI=1S/C10H18O2/c1-2-3-5-8-11-10-7-4-6-9-12-10/h6,9-10H,2-5,7-8H2,1H3
InChIKeyQKYMRRXHWOUTKK-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.84
Rot. Bonds5

About 2-pentoxy-3,4-dihydro-2H-pyran

2-pentoxy-3,4-dihydro-2H-pyran (PubChem CID 67741982) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-pentoxy-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2-pentoxy-3,4-dihydro-2H-pyran
PubChem CID67741982
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-pentoxy-3,4-dihydro-2H-pyran
SMILESCCCCCOC1CCC=CO1
InChIInChI=1S/C10H18O2/c1-2-3-5-8-11-10-7-4-6-9-12-10/h6,9-10H,2-5,7-8H2,1H3
InChIKeyQKYMRRXHWOUTKK-UHFFFAOYSA-N
XLogP2.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-pentyl-3,4-dihydro-2H-pyran
CID 134882670
pentadecoxycyclopentane
CID 155570194
octoxycyclopentane
CID 14691467
(2S)-2-methyl-6-tetradecoxyoxan-3-ol
CID 144591243
2-octacosoxyoxane
CID 11214102
heptoxycyclopropane
CID 54099544
2-decoxy-6-methyloxane
CID 160930984
(2R,3S,4S,5R)-2,3,4,6-tetramethyl-5-pentoxyoxane
CID 59926190
(4R)-4-nonoxyoxetan-2-one
CID 175477617
1-ethoxy-4-hexoxycyclohexane
CID 147022477
(2S,5R)-2,5-dibutoxyoxane
CID 2311827
4-pentoxypiperidine
CID 43167830

Frequently Asked Questions

What is the IUPAC name of 2-pentoxy-3,4-dihydro-2H-pyran?
The IUPAC name of 2-pentoxy-3,4-dihydro-2H-pyran (CID 67741982) is 2-pentoxy-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2-pentoxy-3,4-dihydro-2H-pyran?
The canonical SMILES for 2-pentoxy-3,4-dihydro-2H-pyran is CCCCCOC1CCC=CO1.
What is the InChIKey of 2-pentoxy-3,4-dihydro-2H-pyran?
The InChIKey is QKYMRRXHWOUTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-2-3-5-8-11-10-7-4-6-9-12-10/h6,9-10H,2-5,7-8H2,1H3.
What are the key properties of 2-pentoxy-3,4-dihydro-2H-pyran?
2-pentoxy-3,4-dihydro-2H-pyran has a molecular weight of 170.25 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentoxy-3,4-dihydro-2H-pyran is sourced from PubChem (CID 67741982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).