2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one

C14H14O3 — CID 134987054

IUPAC2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one
SMILESCCc1cc(=O)c2cc3c(cc2o1)CCCO3
InChIInChI=1S/C14H14O3/c1-2-10-7-12(15)11-8-13-9(4-3-5-16-13)6-14(11)17-10/h6-8H,2-5H2,1H3
InChIKeyFHTJEQGRLWCHJJ-UHFFFAOYSA-N
MW230.26 g/mol
LogP2.68
Rot. Bonds1

About 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one

2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one (PubChem CID 134987054) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one.

Molecular Properties

Compound Name2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one
PubChem CID134987054
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one
SMILESCCc1cc(=O)c2cc3c(cc2o1)CCCO3
InChIInChI=1S/C14H14O3/c1-2-10-7-12(15)11-8-13-9(4-3-5-16-13)6-14(11)17-10/h6-8H,2-5H2,1H3
InChIKeyFHTJEQGRLWCHJJ-UHFFFAOYSA-N
XLogP2.68
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Launch Full Analysis

Related Compounds

N-[2-nitro-4-(4-oxo-8,9-dihydro-7H-pyrano[2,3-g]chromen-2-yl)phenyl]acetamide
CID 134910821
3,4,6,7,8,9-hexahydro-2H-pyrano[3,2-h][1]benzoxepine
CID 609172
2-ethyl-7-methoxychromen-4-one
CID 10013150
O-(2-ethyl-4-oxochromen-7-yl) N,N-dimethylcarbamothioate
CID 15171708
2-(6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)acetic acid
CID 172805851
2,3,7,8,9,10-hexahydropyrano[2,3-h][1]benzoxepin-4-one
CID 165353041
oxolan-2-one;propane
CID 91446607
S-(3,4-dihydro-2H-chromen-6-yl) butanethioate
CID 57143611
N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 110693371
(2R)-2-(7-methyl-3,4-dihydro-2H-chromen-6-yl)pyrrolidine
CID 66518876
3,4-dihydro-2H-pyrano[3,2-b]phenoxazin-9-one
CID 22672524
(6-methoxy-3,4-dihydro-2H-chromen-7-yl)methanol
CID 10241724

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one?
The IUPAC name of 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one (CID 134987054) is 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one.
What is the SMILES notation for 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one?
The canonical SMILES for 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one is CCc1cc(=O)c2cc3c(cc2o1)CCCO3.
What is the InChIKey of 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one?
The InChIKey is FHTJEQGRLWCHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c1-2-10-7-12(15)11-8-13-9(4-3-5-16-13)6-14(11)17-10/h6-8H,2-5H2,1H3.
What are the key properties of 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one?
2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one has a molecular weight of 230.26 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-8,9-dihydro-7H-pyrano[2,3-g]chromen-4-one is sourced from PubChem (CID 134987054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).