7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione

C18H24O4 — CID 11266687

IUPAC7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione
SMILESCCCc1c(CCC)c2oc(=O)c(CC)c(CC)c2oc1=O
InChIInChI=1S/C18H24O4/c1-5-9-13-14(10-6-2)18(20)21-15-11(7-3)12(8-4)17(19)22-16(13)15/h5-10H2,1-4H3
InChIKeyQRFUTVGZTNPXCB-UHFFFAOYSA-N
MW304.39 g/mol
LogP3.78
Rot. Bonds6

About 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione

7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione (PubChem CID 11266687) has the molecular formula C18H24O4 and a molecular weight of 304.39 g/mol. Its IUPAC name is 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione.

Molecular Properties

Compound Name7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione
PubChem CID11266687
Molecular FormulaC18H24O4
Molecular Weight304.39 g/mol
Exact Mass304.17
IUPAC Name7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione
SMILESCCCc1c(CCC)c2oc(=O)c(CC)c(CC)c2oc1=O
InChIInChI=1S/C18H24O4/c1-5-9-13-14(10-6-2)18(20)21-15-11(7-3)12(8-4)17(19)22-16(13)15/h5-10H2,1-4H3
InChIKeyQRFUTVGZTNPXCB-UHFFFAOYSA-N
XLogP3.78
TPSA60.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione?
The IUPAC name of 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione (CID 11266687) is 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione.
What is the SMILES notation for 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione?
The canonical SMILES for 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione is CCCc1c(CCC)c2oc(=O)c(CC)c(CC)c2oc1=O.
What is the InChIKey of 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione?
The InChIKey is QRFUTVGZTNPXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O4/c1-5-9-13-14(10-6-2)18(20)21-15-11(7-3)12(8-4)17(19)22-16(13)15/h5-10H2,1-4H3.
What are the key properties of 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione?
7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione has a molecular weight of 304.39 g/mol, XLogP of 3.78, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-diethyl-3,4-dipropylpyrano[3,2-b]pyran-2,6-dione is sourced from PubChem (CID 11266687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).