2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene

C12H13FO — CID 53486334

IUPAC2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene
SMILESFc1ccc2c(c1)CCC(C1CC1)O2
InChIInChI=1S/C12H13FO/c13-10-4-6-12-9(7-10)3-5-11(14-12)8-1-2-8/h4,6-8,11H,1-3,5H2
InChIKeyOSQNTISRBPDELS-UHFFFAOYSA-N
MW192.23 g/mol
LogP2.93
Rot. Bonds1

About 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene

2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene (PubChem CID 53486334) has the molecular formula C12H13FO and a molecular weight of 192.23 g/mol. Its IUPAC name is 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene
PubChem CID53486334
Molecular FormulaC12H13FO
Molecular Weight192.23 g/mol
Exact Mass192.10
IUPAC Name2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene
SMILESFc1ccc2c(c1)CCC(C1CC1)O2
InChIInChI=1S/C12H13FO/c13-10-4-6-12-9(7-10)3-5-11(14-12)8-1-2-8/h4,6-8,11H,1-3,5H2
InChIKeyOSQNTISRBPDELS-UHFFFAOYSA-N
XLogP2.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.23
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene?
The IUPAC name of 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene (CID 53486334) is 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene.
What is the SMILES notation for 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene?
The canonical SMILES for 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene is Fc1ccc2c(c1)CCC(C1CC1)O2.
What is the InChIKey of 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene?
The InChIKey is OSQNTISRBPDELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FO/c13-10-4-6-12-9(7-10)3-5-11(14-12)8-1-2-8/h4,6-8,11H,1-3,5H2.
What are the key properties of 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene?
2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene has a molecular weight of 192.23 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-fluoro-3,4-dihydro-2H-chromene is sourced from PubChem (CID 53486334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).