2-(2,5-difluorophenyl)ethylurea

C9H10F2N2O — CID 115168493

IUPAC2-(2,5-difluorophenyl)ethylurea
SMILESNC(=O)NCCc1cc(F)ccc1F
InChIInChI=1S/C9H10F2N2O/c10-7-1-2-8(11)6(5-7)3-4-13-9(12)14/h1-2,5H,3-4H2,(H3,12,13,14)
InChIKeySYERSHLWLHJDGE-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.18
Rot. Bonds3

About 2-(2,5-difluorophenyl)ethylurea

2-(2,5-difluorophenyl)ethylurea (PubChem CID 115168493) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)ethylurea.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)ethylurea
PubChem CID115168493
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-(2,5-difluorophenyl)ethylurea
SMILESNC(=O)NCCc1cc(F)ccc1F
InChIInChI=1S/C9H10F2N2O/c10-7-1-2-8(11)6(5-7)3-4-13-9(12)14/h1-2,5H,3-4H2,(H3,12,13,14)
InChIKeySYERSHLWLHJDGE-UHFFFAOYSA-N
XLogP1.18
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-N-[2-(2,5-difluorophenyl)ethyl]acetamide
CID 82492756
2-[(2,5-difluorophenyl)methylamino]ethylurea
CID 83111439
2-amino-N-[2-(2,5-difluorophenyl)ethyl]propanamide
CID 115152492
N-[2-(2,5-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110788175
N-[2-(2,5-difluorophenyl)ethyl]propanamide
CID 71113752
1-[2-(2,5-difluorophenyl)ethyl]-3-(2-hydroxyethyl)urea
CID 111573173
1-amino-N-[2-(2,5-difluorophenyl)ethyl]cyclopropane-1-carboxamide
CID 115189941
N-[2-(2,5-difluorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110788190
N-[2-(2,5-difluorophenyl)ethyl]benzamide
CID 110788162
1-[2-(2,5-difluorophenyl)ethyl]-3-(3-hydroxypropyl)urea
CID 71981439
1-[2-(2,5-difluorophenyl)ethyl]-2-methylguanidine;hydroiodide
CID 111573049
2-(2,5-difluorophenyl)acetamide
CID 21245498

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)ethylurea?
The IUPAC name of 2-(2,5-difluorophenyl)ethylurea (CID 115168493) is 2-(2,5-difluorophenyl)ethylurea.
What is the SMILES notation for 2-(2,5-difluorophenyl)ethylurea?
The canonical SMILES for 2-(2,5-difluorophenyl)ethylurea is NC(=O)NCCc1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)ethylurea?
The InChIKey is SYERSHLWLHJDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c10-7-1-2-8(11)6(5-7)3-4-13-9(12)14/h1-2,5H,3-4H2,(H3,12,13,14).
What are the key properties of 2-(2,5-difluorophenyl)ethylurea?
2-(2,5-difluorophenyl)ethylurea has a molecular weight of 200.19 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)ethylurea is sourced from PubChem (CID 115168493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).