(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone

C10H6FNO2 — CID 16743432

IUPAC(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone
SMILESO=C(c1ccc(F)cc1)c1ncco1
InChIInChI=1S/C10H6FNO2/c11-8-3-1-7(2-4-8)9(13)10-12-5-6-14-10/h1-6H
InChIKeyMZUVMBGDHXJAKO-UHFFFAOYSA-N
MW191.16 g/mol
LogP2.04
Rot. Bonds2

About (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone

(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone (PubChem CID 16743432) has the molecular formula C10H6FNO2 and a molecular weight of 191.16 g/mol. Its IUPAC name is (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone
PubChem CID16743432
Molecular FormulaC10H6FNO2
Molecular Weight191.16 g/mol
Exact Mass191.04
IUPAC Name(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone
SMILESO=C(c1ccc(F)cc1)c1ncco1
InChIInChI=1S/C10H6FNO2/c11-8-3-1-7(2-4-8)9(13)10-12-5-6-14-10/h1-6H
InChIKeyMZUVMBGDHXJAKO-UHFFFAOYSA-N
XLogP2.04
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5,6-dimethyl-3-pyridinyl)-(1,3-oxazol-2-yl)methanone;ethane
CID 144572444
2-(4-fluorophenyl)-3-(1,3-oxazol-2-yl)prop-2-enal
CID 54180147
(4-fluorophenyl)-pyridin-3-ylmethanone
CID 762660
(4-fluorophenyl)-(3-methylfuran-2-yl)methanone
CID 43462648
(4-fluorophenyl)-phenylmethanone
CID 161464622
(4-amino-3-pyridinyl)-(4-fluorophenyl)methanone
CID 11074797
4-(4-fluorobenzoyl)pyridine-3-carboxylic acid
CID 10752867
bis(4-chlorophenyl)methanone;bis(4-fluorophenyl)methanone
CID 159883474
(E)-2-[1-(4-fluorophenyl)ethylideneamino]-10-(1,3-oxazol-2-yl)-10-oxo-3-propyldec-2-enenitrile
CID 146336619
1,3-oxazole-2-carboxylic acid;pyridine-3-carboxylic acid
CID 66925198
3-(4-fluorobenzoyl)pyridine-2-carboxylic acid
CID 10014744
(4-fluorophenyl)-(1,3-oxazol-2-yl)methanol
CID 68870928

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone?
The IUPAC name of (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone (CID 16743432) is (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone?
The canonical SMILES for (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone is O=C(c1ccc(F)cc1)c1ncco1.
What is the InChIKey of (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone?
The InChIKey is MZUVMBGDHXJAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FNO2/c11-8-3-1-7(2-4-8)9(13)10-12-5-6-14-10/h1-6H.
What are the key properties of (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone?
(4-fluorophenyl)-(1,3-oxazol-2-yl)methanone has a molecular weight of 191.16 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(1,3-oxazol-2-yl)methanone is sourced from PubChem (CID 16743432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).