1-methyl-3-naphthalen-2-ylurea

C12H12N2O — CID 3454681

IUPAC1-methyl-3-naphthalen-2-ylurea
SMILESCNC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C12H12N2O/c1-13-12(15)14-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H2,13,14,15)
InChIKeyGBZFNHQFPMVGTF-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.59
Rot. Bonds1

About 1-methyl-3-naphthalen-2-ylurea

1-methyl-3-naphthalen-2-ylurea (PubChem CID 3454681) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 1-methyl-3-naphthalen-2-ylurea.

Molecular Properties

Compound Name1-methyl-3-naphthalen-2-ylurea
PubChem CID3454681
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name1-methyl-3-naphthalen-2-ylurea
SMILESCNC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C12H12N2O/c1-13-12(15)14-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H2,13,14,15)
InChIKeyGBZFNHQFPMVGTF-UHFFFAOYSA-N
XLogP2.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,4-dimethylphenyl)-3-naphthalen-2-ylurea
CID 108894077
1-(4-tert-butylphenyl)-3-naphthalen-2-ylurea
CID 108884834
1-(3,5-dihydroxyphenyl)-3-naphthalen-2-ylurea
CID 108895519
1-(5-bromonaphthalen-2-yl)-3-methylurea
CID 146021922
N-naphthalen-2-ylcarbamoyl bromide
CID 115193346
1-naphthalen-2-yl-3-(1-phenylethyl)urea
CID 78400043
1-[(E)-3,3-dimethylbut-1-enyl]-3-naphthalen-2-ylurea
CID 108911462
N-[3-[4-(methylcarbamoylamino)anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55596125
N-[3-(naphthalen-2-ylcarbamoylsulfamoyl)phenyl]acetamide
CID 139878374
(Z)-4-(naphthalen-2-ylamino)pent-3-en-2-one
CID 7335849
1-(3-hydroxybutyl)-3-naphthalen-2-ylurea
CID 111336742
1-(2-methoxyethoxymethyl)-3-naphthalen-2-ylurea
CID 108894459

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-naphthalen-2-ylurea?
The IUPAC name of 1-methyl-3-naphthalen-2-ylurea (CID 3454681) is 1-methyl-3-naphthalen-2-ylurea.
What is the SMILES notation for 1-methyl-3-naphthalen-2-ylurea?
The canonical SMILES for 1-methyl-3-naphthalen-2-ylurea is CNC(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of 1-methyl-3-naphthalen-2-ylurea?
The InChIKey is GBZFNHQFPMVGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-13-12(15)14-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H2,13,14,15).
What are the key properties of 1-methyl-3-naphthalen-2-ylurea?
1-methyl-3-naphthalen-2-ylurea has a molecular weight of 200.24 g/mol, XLogP of 2.59, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-naphthalen-2-ylurea is sourced from PubChem (CID 3454681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).