1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea

C18H14N4O2 — CID 48746862

IUPAC1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
SMILESO=C(Nc1ccc2ccccc2c1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C18H14N4O2/c23-17(19-13-6-5-11-3-1-2-4-12(11)9-13)20-14-7-8-15-16(10-14)22-18(24)21-15/h1-10H,(H2,19,20,23)(H2,21,22,24)
InChIKeyUHURZOFHADPIFB-UHFFFAOYSA-N
MW318.34 g/mol
LogP3.65
Rot. Bonds2

About 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea

1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea (PubChem CID 48746862) has the molecular formula C18H14N4O2 and a molecular weight of 318.34 g/mol. Its IUPAC name is 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea.

Molecular Properties

Compound Name1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
PubChem CID48746862
Molecular FormulaC18H14N4O2
Molecular Weight318.34 g/mol
Exact Mass318.11
IUPAC Name1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
SMILESO=C(Nc1ccc2ccccc2c1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C18H14N4O2/c23-17(19-13-6-5-11-3-1-2-4-12(11)9-13)20-14-7-8-15-16(10-14)22-18(24)21-15/h1-10H,(H2,19,20,23)(H2,21,22,24)
InChIKeyUHURZOFHADPIFB-UHFFFAOYSA-N
XLogP3.65
TPSA89.78 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 53.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
CID 115192410
1-(3-iodophenyl)-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
CID 48742366
1-(3,5-dichlorophenyl)-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea
CID 48743188
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-indole-2-carboxamide
CID 42982780
phenyl N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamate
CID 10236287
2-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,3-dihydrobenzimidazole-5-carboxamide
CID 59347105
1-(3,5-dihydroxyphenyl)-3-naphthalen-2-ylurea
CID 108895519
5-(1-anilinoethenylamino)-1,3-dihydrobenzimidazol-2-one
CID 155113901
1-methyl-3-naphthalen-2-ylurea
CID 3454681
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-phenylsulfanylacetamide
CID 6459618
1-(3,4-dimethylphenyl)-3-naphthalen-2-ylurea
CID 108894077
2,2-difluoro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 103605142

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea?
The IUPAC name of 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea (CID 48746862) is 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea.
What is the SMILES notation for 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea?
The canonical SMILES for 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea is O=C(Nc1ccc2ccccc2c1)Nc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea?
The InChIKey is UHURZOFHADPIFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O2/c23-17(19-13-6-5-11-3-1-2-4-12(11)9-13)20-14-7-8-15-16(10-14)22-18(24)21-15/h1-10H,(H2,19,20,23)(H2,21,22,24).
What are the key properties of 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea?
1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea has a molecular weight of 318.34 g/mol, XLogP of 3.65, 2 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)urea is sourced from PubChem (CID 48746862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).