1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea

C16H16N2O3 — CID 86976519

IUPAC1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea
SMILESCCNC(=O)Nc1cc2oc3ccccc3c2cc1OC
InChIInChI=1S/C16H16N2O3/c1-3-17-16(19)18-12-9-14-11(8-15(12)20-2)10-6-4-5-7-13(10)21-14/h4-9H,3H2,1-2H3,(H2,17,18,19)
InChIKeyJCQGTAMBRJMTIW-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.74
Rot. Bonds3

About 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea

1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea (PubChem CID 86976519) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea.

Molecular Properties

Compound Name1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea
PubChem CID86976519
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea
SMILESCCNC(=O)Nc1cc2oc3ccccc3c2cc1OC
InChIInChI=1S/C16H16N2O3/c1-3-17-16(19)18-12-9-14-11(8-15(12)20-2)10-6-4-5-7-13(10)21-14/h4-9H,3H2,1-2H3,(H2,17,18,19)
InChIKeyJCQGTAMBRJMTIW-UHFFFAOYSA-N
XLogP3.74
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxydibenzofuran-3-yl)-3-[[4-(methoxymethyl)phenyl]methyl]urea
CID 55696455
1-[2-(methanesulfonamido)ethyl]-3-(2-methoxydibenzofuran-3-yl)urea
CID 71895973
N-(2-methoxydibenzofuran-3-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674201
1-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxydibenzofuran-3-yl)urea
CID 4256084
1-(2-hydroxy-1-phenylethyl)-3-(2-methoxydibenzofuran-3-yl)urea
CID 72686859
(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2421462
N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
CID 2935191
(2R)-2-(carbamoylamino)-N-(2-methoxydibenzofuran-3-yl)-3-methylbutanamide
CID 40799365
2-[[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78826575
2-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]sulfanylacetic acid
CID 2401504
(2S)-2-(benzylamino)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2317955
2-(4-ethylpyridin-1-ium-1-yl)-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 2489195

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea?
The IUPAC name of 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea (CID 86976519) is 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea.
What is the SMILES notation for 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea?
The canonical SMILES for 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea is CCNC(=O)Nc1cc2oc3ccccc3c2cc1OC.
What is the InChIKey of 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea?
The InChIKey is JCQGTAMBRJMTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-3-17-16(19)18-12-9-14-11(8-15(12)20-2)10-6-4-5-7-13(10)21-14/h4-9H,3H2,1-2H3,(H2,17,18,19).
What are the key properties of 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea?
1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea has a molecular weight of 284.32 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea is sourced from PubChem (CID 86976519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).