1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea

C15H13FN2O2 — CID 110866388

IUPAC1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea
SMILESO=C(Nc1ccc2c(c1)CCO2)Nc1ccccc1F
InChIInChI=1S/C15H13FN2O2/c16-12-3-1-2-4-13(12)18-15(19)17-11-5-6-14-10(9-11)7-8-20-14/h1-6,9H,7-8H2,(H2,17,18,19)
InChIKeySAPXOLYFSXCBNL-UHFFFAOYSA-N
MW272.28 g/mol
LogP3.40
Rot. Bonds2

About 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea

1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea (PubChem CID 110866388) has the molecular formula C15H13FN2O2 and a molecular weight of 272.28 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea
PubChem CID110866388
Molecular FormulaC15H13FN2O2
Molecular Weight272.28 g/mol
Exact Mass272.10
IUPAC Name1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea
SMILESO=C(Nc1ccc2c(c1)CCO2)Nc1ccccc1F
InChIInChI=1S/C15H13FN2O2/c16-12-3-1-2-4-13(12)18-15(19)17-11-5-6-14-10(9-11)7-8-20-14/h1-6,9H,7-8H2,(H2,17,18,19)
InChIKeySAPXOLYFSXCBNL-UHFFFAOYSA-N
XLogP3.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.28
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 110693454
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dihydro-1-benzofuran-5-yl)urea
CID 110866610
2-(2,3-dihydro-1-benzofuran-5-yl)-N-(2-fluorophenyl)acetamide
CID 51309459
1-(3-bromophenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)urea
CID 110866595
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(3,4-dimethoxyphenyl)urea
CID 110866492
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(4-methoxyphenyl)urea
CID 25352937
2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1,4-diium-1-yl]-N-(2-fluorophenyl)acetamide
CID 9126689
1-(2,3-dihydro-1-benzofuran-5-yl)-3-[(3-fluoro-4-methylphenyl)methyl]urea
CID 30886416
2-bromo-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
CID 107903969
N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide
CID 115497334
[4-(2,3-dihydro-1-benzofuran-5-ylcarbamoylamino)phenyl] sulfamate
CID 70694605
1-(2,3-dihydro-1-benzofuran-5-yl)-3-[(2S,3R)-2-phenyloxolan-3-yl]urea
CID 129397274

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea (CID 110866388) is 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea is O=C(Nc1ccc2c(c1)CCO2)Nc1ccccc1F.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea?
The InChIKey is SAPXOLYFSXCBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O2/c16-12-3-1-2-4-13(12)18-15(19)17-11-5-6-14-10(9-11)7-8-20-14/h1-6,9H,7-8H2,(H2,17,18,19).
What are the key properties of 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea?
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea has a molecular weight of 272.28 g/mol, XLogP of 3.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea is sourced from PubChem (CID 110866388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).