1-naphthalen-1-yl-1-sulfamoylurea

C11H11N3O3S — CID 174809861

IUPAC1-naphthalen-1-yl-1-sulfamoylurea
SMILESNC(=O)N(c1cccc2ccccc12)S(N)(=O)=O
InChIInChI=1S/C11H11N3O3S/c12-11(15)14(18(13,16)17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,12,15)(H2,13,16,17)
InChIKeyWJSDMMJMTPTMFM-UHFFFAOYSA-N
MW265.29 g/mol
LogP0.93
Rot. Bonds2

About 1-naphthalen-1-yl-1-sulfamoylurea

1-naphthalen-1-yl-1-sulfamoylurea (PubChem CID 174809861) has the molecular formula C11H11N3O3S and a molecular weight of 265.29 g/mol. Its IUPAC name is 1-naphthalen-1-yl-1-sulfamoylurea.

Molecular Properties

Compound Name1-naphthalen-1-yl-1-sulfamoylurea
PubChem CID174809861
Molecular FormulaC11H11N3O3S
Molecular Weight265.29 g/mol
Exact Mass265.05
IUPAC Name1-naphthalen-1-yl-1-sulfamoylurea
SMILESNC(=O)N(c1cccc2ccccc12)S(N)(=O)=O
InChIInChI=1S/C11H11N3O3S/c12-11(15)14(18(13,16)17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,12,15)(H2,13,16,17)
InChIKeyWJSDMMJMTPTMFM-UHFFFAOYSA-N
XLogP0.93
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N,N-dimethylnaphthalen-1-amine;hydroxylamine
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1,1,2,2-tetranaphthalen-1-ylhydrazine
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2-amino-N-ethyl-2-methyl-N-naphthalen-1-ylpropanamide
CID 61265760
N-(2-hydrazinyl-2-oxoethyl)-N-naphthalen-1-ylmethanesulfonamide
CID 50895807
3-amino-1-methyl-1-naphthalen-1-ylurea
CID 115192586
chloro(naphthalen-1-yl)carbamic acid;hydrochloride
CID 88734221
methyl N-methoxycarbonyl-N-naphthalen-1-ylcarbamate
CID 138084079
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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-1-sulfamoylurea?
The IUPAC name of 1-naphthalen-1-yl-1-sulfamoylurea (CID 174809861) is 1-naphthalen-1-yl-1-sulfamoylurea.
What is the SMILES notation for 1-naphthalen-1-yl-1-sulfamoylurea?
The canonical SMILES for 1-naphthalen-1-yl-1-sulfamoylurea is NC(=O)N(c1cccc2ccccc12)S(N)(=O)=O.
What is the InChIKey of 1-naphthalen-1-yl-1-sulfamoylurea?
The InChIKey is WJSDMMJMTPTMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3S/c12-11(15)14(18(13,16)17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,12,15)(H2,13,16,17).
What are the key properties of 1-naphthalen-1-yl-1-sulfamoylurea?
1-naphthalen-1-yl-1-sulfamoylurea has a molecular weight of 265.29 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-1-sulfamoylurea is sourced from PubChem (CID 174809861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).