1-(4-fluorophenyl)-3-pyridin-2-ylurea

C12H10FN3O — CID 17267918

IUPAC1-(4-fluorophenyl)-3-pyridin-2-ylurea
SMILESO=C(Nc1ccc(F)cc1)Nc1ccccn1
InChIInChI=1S/C12H10FN3O/c13-9-4-6-10(7-5-9)15-12(17)16-11-3-1-2-8-14-11/h1-8H,(H2,14,15,16,17)
InChIKeyBATFOJVZVVSTFV-UHFFFAOYSA-N
MW231.23 g/mol
LogP2.86
Rot. Bonds2

About 1-(4-fluorophenyl)-3-pyridin-2-ylurea

1-(4-fluorophenyl)-3-pyridin-2-ylurea (PubChem CID 17267918) has the molecular formula C12H10FN3O and a molecular weight of 231.23 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-pyridin-2-ylurea.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-pyridin-2-ylurea
PubChem CID17267918
Molecular FormulaC12H10FN3O
Molecular Weight231.23 g/mol
Exact Mass231.08
IUPAC Name1-(4-fluorophenyl)-3-pyridin-2-ylurea
SMILESO=C(Nc1ccc(F)cc1)Nc1ccccn1
InChIInChI=1S/C12H10FN3O/c13-9-4-6-10(7-5-9)15-12(17)16-11-3-1-2-8-14-11/h1-8H,(H2,14,15,16,17)
InChIKeyBATFOJVZVVSTFV-UHFFFAOYSA-N
XLogP2.86
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-3-pyrimidin-2-ylurea
CID 4066669
1-(4-ethylphenyl)-3-pyridin-2-ylurea
CID 6469550
1-(4-cyanophenyl)-3-pyridin-2-ylurea
CID 108894633
1-[1-(4-fluorophenyl)cyclopropyl]-3-pyridin-2-ylurea
CID 110676420
1-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-3-(4-fluorophenyl)urea
CID 67062221
1-hydroxy-3-pyridin-2-ylurea
CID 20612761
(2R)-2-(4-fluorophenyl)-2-(pyridin-2-ylcarbamoylamino)acetamide
CID 100749906
N-[4-(pyridin-2-ylcarbamoylamino)phenyl]sulfonylacetamide
CID 110492034
1-(3-methylsulfanylphenyl)-3-pyridin-2-ylurea
CID 46891619
1-(2-bromophenyl)-3-(4-fluorophenyl)urea
CID 835097
1-(4-fluorophenyl)-3-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]urea
CID 121112892
1-carbamoyl-3-pyridin-2-ylurea
CID 564989

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-pyridin-2-ylurea?
The IUPAC name of 1-(4-fluorophenyl)-3-pyridin-2-ylurea (CID 17267918) is 1-(4-fluorophenyl)-3-pyridin-2-ylurea.
What is the SMILES notation for 1-(4-fluorophenyl)-3-pyridin-2-ylurea?
The canonical SMILES for 1-(4-fluorophenyl)-3-pyridin-2-ylurea is O=C(Nc1ccc(F)cc1)Nc1ccccn1.
What is the InChIKey of 1-(4-fluorophenyl)-3-pyridin-2-ylurea?
The InChIKey is BATFOJVZVVSTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O/c13-9-4-6-10(7-5-9)15-12(17)16-11-3-1-2-8-14-11/h1-8H,(H2,14,15,16,17).
What are the key properties of 1-(4-fluorophenyl)-3-pyridin-2-ylurea?
1-(4-fluorophenyl)-3-pyridin-2-ylurea has a molecular weight of 231.23 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-pyridin-2-ylurea is sourced from PubChem (CID 17267918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).