2-cyclopropyl-2,3-dihydrochromen-4-one

C12H12O2 — CID 114671469

IUPAC2-cyclopropyl-2,3-dihydrochromen-4-one
SMILESO=C1CC(C2CC2)Oc2ccccc21
InChIInChI=1S/C12H12O2/c13-10-7-12(8-5-6-8)14-11-4-2-1-3-9(10)11/h1-4,8,12H,5-7H2
InChIKeySUKUANLWBKMUBG-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.43
Rot. Bonds1

About 2-cyclopropyl-2,3-dihydrochromen-4-one

2-cyclopropyl-2,3-dihydrochromen-4-one (PubChem CID 114671469) has the molecular formula C12H12O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-cyclopropyl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name2-cyclopropyl-2,3-dihydrochromen-4-one
PubChem CID114671469
Molecular FormulaC12H12O2
Molecular Weight188.23 g/mol
Exact Mass188.08
IUPAC Name2-cyclopropyl-2,3-dihydrochromen-4-one
SMILESO=C1CC(C2CC2)Oc2ccccc21
InChIInChI=1S/C12H12O2/c13-10-7-12(8-5-6-8)14-11-4-2-1-3-9(10)11/h1-4,8,12H,5-7H2
InChIKeySUKUANLWBKMUBG-UHFFFAOYSA-N
XLogP2.43
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2,3-dihydrochromen-4-one?
The IUPAC name of 2-cyclopropyl-2,3-dihydrochromen-4-one (CID 114671469) is 2-cyclopropyl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 2-cyclopropyl-2,3-dihydrochromen-4-one?
The canonical SMILES for 2-cyclopropyl-2,3-dihydrochromen-4-one is O=C1CC(C2CC2)Oc2ccccc21.
What is the InChIKey of 2-cyclopropyl-2,3-dihydrochromen-4-one?
The InChIKey is SUKUANLWBKMUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2/c13-10-7-12(8-5-6-8)14-11-4-2-1-3-9(10)11/h1-4,8,12H,5-7H2.
What are the key properties of 2-cyclopropyl-2,3-dihydrochromen-4-one?
2-cyclopropyl-2,3-dihydrochromen-4-one has a molecular weight of 188.23 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 114671469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).