ethane;5-propan-2-yl-3,4-dihydro-2H-pyran

C10H20O — CID 143052742

IUPACethane;5-propan-2-yl-3,4-dihydro-2H-pyran
SMILESCC.CC(C)C1=COCCC1
InChIInChI=1S/C8H14O.C2H6/c1-7(2)8-4-3-5-9-6-8;1-2/h6-7H,3-5H2,1-2H3;1-2H3
InChIKeyHATOIVYZWYXNFM-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.36
Rot. Bonds1

About ethane;5-propan-2-yl-3,4-dihydro-2H-pyran

ethane;5-propan-2-yl-3,4-dihydro-2H-pyran (PubChem CID 143052742) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is ethane;5-propan-2-yl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Nameethane;5-propan-2-yl-3,4-dihydro-2H-pyran
PubChem CID143052742
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Nameethane;5-propan-2-yl-3,4-dihydro-2H-pyran
SMILESCC.CC(C)C1=COCCC1
InChIInChI=1S/C8H14O.C2H6/c1-7(2)8-4-3-5-9-6-8;1-2/h6-7H,3-5H2,1-2H3;1-2H3
InChIKeyHATOIVYZWYXNFM-UHFFFAOYSA-N
XLogP3.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;5-propan-2-yl-3,4-dihydro-2H-pyran?
The IUPAC name of ethane;5-propan-2-yl-3,4-dihydro-2H-pyran (CID 143052742) is ethane;5-propan-2-yl-3,4-dihydro-2H-pyran.
What is the SMILES notation for ethane;5-propan-2-yl-3,4-dihydro-2H-pyran?
The canonical SMILES for ethane;5-propan-2-yl-3,4-dihydro-2H-pyran is CC.CC(C)C1=COCCC1.
What is the InChIKey of ethane;5-propan-2-yl-3,4-dihydro-2H-pyran?
The InChIKey is HATOIVYZWYXNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O.C2H6/c1-7(2)8-4-3-5-9-6-8;1-2/h6-7H,3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;5-propan-2-yl-3,4-dihydro-2H-pyran?
ethane;5-propan-2-yl-3,4-dihydro-2H-pyran has a molecular weight of 156.27 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-propan-2-yl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 143052742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).