ethane;1-(4-ethylphenyl)-3-methylurea

C14H26N2O — CID 143679761

IUPACethane;1-(4-ethylphenyl)-3-methylurea
SMILESCC.CC.CCc1ccc(NC(=O)NC)cc1
InChIInChI=1S/C10H14N2O.2C2H6/c1-3-8-4-6-9(7-5-8)12-10(13)11-2;2*1-2/h4-7H,3H2,1-2H3,(H2,11,12,13);2*1-2H3
InChIKeyWSOWJWPPOLGGNP-UHFFFAOYSA-N
MW238.37 g/mol
LogP4.05
Rot. Bonds2

About ethane;1-(4-ethylphenyl)-3-methylurea

ethane;1-(4-ethylphenyl)-3-methylurea (PubChem CID 143679761) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is ethane;1-(4-ethylphenyl)-3-methylurea.

Molecular Properties

Compound Nameethane;1-(4-ethylphenyl)-3-methylurea
PubChem CID143679761
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Nameethane;1-(4-ethylphenyl)-3-methylurea
SMILESCC.CC.CCc1ccc(NC(=O)NC)cc1
InChIInChI=1S/C10H14N2O.2C2H6/c1-3-8-4-6-9(7-5-8)12-10(13)11-2;2*1-2/h4-7H,3H2,1-2H3,(H2,11,12,13);2*1-2H3
InChIKeyWSOWJWPPOLGGNP-UHFFFAOYSA-N
XLogP4.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-ethylphenyl)-3-methylurea
CID 54250791
1-ethyl-3-(4-ethylphenyl)urea
CID 20721116
1-(4-benzylphenyl)-3-methylurea
CID 145326557
1-(4-tert-butylphenyl)-3-(4-ethylphenyl)urea
CID 58441349
4-[(4-ethylphenyl)carbamoylamino]benzoic acid
CID 23551476
1-(4-butylphenyl)-3-(4-ethylphenyl)urea
CID 4616049
1-(4-ethylphenyl)-3-(4-propan-2-ylphenyl)urea
CID 4111810
1-methyl-3-phenylurea;propane
CID 142949663
1-methyl-3-[4-(phenylsulfanylmethyl)phenyl]urea
CID 134116571
2-[(4-ethylphenyl)carbamoylamino]propanoic acid
CID 4026936
2-(4-ethylanilino)-N-(methylcarbamoyl)acetamide
CID 46537872
3-[(4-ethylphenyl)carbamoylamino]propanoic acid
CID 28510852

Frequently Asked Questions

What is the IUPAC name of ethane;1-(4-ethylphenyl)-3-methylurea?
The IUPAC name of ethane;1-(4-ethylphenyl)-3-methylurea (CID 143679761) is ethane;1-(4-ethylphenyl)-3-methylurea.
What is the SMILES notation for ethane;1-(4-ethylphenyl)-3-methylurea?
The canonical SMILES for ethane;1-(4-ethylphenyl)-3-methylurea is CC.CC.CCc1ccc(NC(=O)NC)cc1.
What is the InChIKey of ethane;1-(4-ethylphenyl)-3-methylurea?
The InChIKey is WSOWJWPPOLGGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.2C2H6/c1-3-8-4-6-9(7-5-8)12-10(13)11-2;2*1-2/h4-7H,3H2,1-2H3,(H2,11,12,13);2*1-2H3.
What are the key properties of ethane;1-(4-ethylphenyl)-3-methylurea?
ethane;1-(4-ethylphenyl)-3-methylurea has a molecular weight of 238.37 g/mol, XLogP of 4.05, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(4-ethylphenyl)-3-methylurea is sourced from PubChem (CID 143679761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).