ethane;(2-methoxy-5-methylphenyl)urea

C11H18N2O2 — CID 142042876

IUPACethane;(2-methoxy-5-methylphenyl)urea
SMILESCC.COc1ccc(C)cc1NC(N)=O
InChIInChI=1S/C9H12N2O2.C2H6/c1-6-3-4-8(13-2)7(5-6)11-9(10)12;1-2/h3-5H,1-2H3,(H3,10,11,12);1-2H3
InChIKeySCEBOCXHXTUDPV-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.52
Rot. Bonds2

About ethane;(2-methoxy-5-methylphenyl)urea

ethane;(2-methoxy-5-methylphenyl)urea (PubChem CID 142042876) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is ethane;(2-methoxy-5-methylphenyl)urea.

Molecular Properties

Compound Nameethane;(2-methoxy-5-methylphenyl)urea
PubChem CID142042876
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Nameethane;(2-methoxy-5-methylphenyl)urea
SMILESCC.COc1ccc(C)cc1NC(N)=O
InChIInChI=1S/C9H12N2O2.C2H6/c1-6-3-4-8(13-2)7(5-6)11-9(10)12;1-2/h3-5H,1-2H3,(H3,10,11,12);1-2H3
InChIKeySCEBOCXHXTUDPV-UHFFFAOYSA-N
XLogP2.52
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
1-(carbamothioylamino)-3-(2-methoxy-5-methylphenyl)urea
CID 44725083
ethane;(2-methoxyphenyl)urea
CID 143063924
[2-[(2-methoxy-4,5-dimethylphenyl)diazenyl]-5-methylphenyl]urea
CID 157197459
4-amino-N-(2-methoxy-5-methylphenyl)-4-sulfanylidenebutanamide
CID 94270072
N,N'-bis(2-methoxy-5-methylphenyl)pentanediamide
CID 5142107
1-(2-methoxy-5-methylphenyl)-3-(4-methylphenyl)urea
CID 16640797
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)-3,3-dimethylbutanamide
CID 61149030
N-(4-carbamoylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 45001353
N-(2-methoxy-5-methylphenyl)-2,4,6-trimethylbenzamide
CID 19174112
2-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide
CID 1447930
1-(2-aminoethyl)-3-(2-methoxy-5-methylphenyl)urea
CID 82080459

Frequently Asked Questions

What is the IUPAC name of ethane;(2-methoxy-5-methylphenyl)urea?
The IUPAC name of ethane;(2-methoxy-5-methylphenyl)urea (CID 142042876) is ethane;(2-methoxy-5-methylphenyl)urea.
What is the SMILES notation for ethane;(2-methoxy-5-methylphenyl)urea?
The canonical SMILES for ethane;(2-methoxy-5-methylphenyl)urea is CC.COc1ccc(C)cc1NC(N)=O.
What is the InChIKey of ethane;(2-methoxy-5-methylphenyl)urea?
The InChIKey is SCEBOCXHXTUDPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2.C2H6/c1-6-3-4-8(13-2)7(5-6)11-9(10)12;1-2/h3-5H,1-2H3,(H3,10,11,12);1-2H3.
What are the key properties of ethane;(2-methoxy-5-methylphenyl)urea?
ethane;(2-methoxy-5-methylphenyl)urea has a molecular weight of 210.28 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2-methoxy-5-methylphenyl)urea is sourced from PubChem (CID 142042876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).