(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol

C8H10FNO2 — CID 105434687

IUPAC(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol
SMILESCC1(F)CCc2onc(CO)c21
InChIInChI=1S/C8H10FNO2/c1-8(9)3-2-6-7(8)5(4-11)10-12-6/h11H,2-4H2,1H3
InChIKeyRRFUKANLDWYWEW-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.30
Rot. Bonds1

About (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol

(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol (PubChem CID 105434687) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol
PubChem CID105434687
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol
SMILESCC1(F)CCc2onc(CO)c21
InChIInChI=1S/C8H10FNO2/c1-8(9)3-2-6-7(8)5(4-11)10-12-6/h11H,2-4H2,1H3
InChIKeyRRFUKANLDWYWEW-UHFFFAOYSA-N
XLogP1.30
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

{4H,5H,6H-cyclopenta[d][1,2]oxazol-3-yl}methanol
CID 23006253
(5,5-Difluoro-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanol
CID 155820023
6-fluoro-3-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
CID 89095932
[5-(2-Methylpropyl)-4-(trifluoromethyl)-1,2-oxazol-3-yl]methanol
CID 91084799
5,6-Dihydro-4H-cyclopenta[d]isoxazole-3-carboxylic acid
CID 23006221
(6-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)methanol
CID 105430602
(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)methanol
CID 105430603
4-Fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazole-3-carbaldehyde
CID 105434013
1-(4-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazol-3-yl)ethanone
CID 105434014
6-fluoro-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole-3-carboxylic acid
CID 105434647
(4-Fluoro-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanol
CID 105434686
(6,6-Difluoro-4,5-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol
CID 105435958

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol?
The IUPAC name of (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol (CID 105434687) is (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol.
What is the SMILES notation for (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol?
The canonical SMILES for (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol is CC1(F)CCc2onc(CO)c21.
What is the InChIKey of (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol?
The InChIKey is RRFUKANLDWYWEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-8(9)3-2-6-7(8)5(4-11)10-12-6/h11H,2-4H2,1H3.
What are the key properties of (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol?
(4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol has a molecular weight of 171.17 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-4-methyl-5,6-dihydrocyclopenta[d][1,2]oxazol-3-yl)methanol is sourced from PubChem (CID 105434687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).