1-(4-ethyl-2-methylphenyl)-3-methylurea

C11H16N2O — CID 23348894

IUPAC1-(4-ethyl-2-methylphenyl)-3-methylurea
SMILESCCc1ccc(NC(=O)NC)c(C)c1
InChIInChI=1S/C11H16N2O/c1-4-9-5-6-10(8(2)7-9)13-11(14)12-3/h5-7H,4H2,1-3H3,(H2,12,13,14)
InChIKeyDBXJFCUTVAGLBR-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.31
Rot. Bonds2

About 1-(4-ethyl-2-methylphenyl)-3-methylurea

1-(4-ethyl-2-methylphenyl)-3-methylurea (PubChem CID 23348894) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-(4-ethyl-2-methylphenyl)-3-methylurea.

Molecular Properties

Compound Name1-(4-ethyl-2-methylphenyl)-3-methylurea
PubChem CID23348894
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name1-(4-ethyl-2-methylphenyl)-3-methylurea
SMILESCCc1ccc(NC(=O)NC)c(C)c1
InChIInChI=1S/C11H16N2O/c1-4-9-5-6-10(8(2)7-9)13-11(14)12-3/h5-7H,4H2,1-3H3,(H2,12,13,14)
InChIKeyDBXJFCUTVAGLBR-UHFFFAOYSA-N
XLogP2.31
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-ethyl-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-3-methylurea
CID 126515913
1-(2-chlorophenyl)-3-(4-ethyl-2-methylphenyl)urea
CID 71013489
1-(4-iodo-2-methylphenyl)-3-methylurea
CID 47127604
1-[4-(aminomethyl)-2-methylphenyl]-3-ethylurea
CID 82507372
1-[4-ethenyl-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-3-methylurea
CID 126515985
1-(4-ethylphenyl)-3-methylurea
CID 54250791
ethane;1-(4-ethylphenyl)-3-methylurea
CID 143679761
1-[5-(difluoromethyl)-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-3-methylurea
CID 126515823
1-[2-[(4-ethyl-2-methylphenoxy)methyl]-5-(trifluoromethyl)phenyl]-3-methylurea
CID 126588608
1-[3-(difluoromethyl)-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-3-methylurea
CID 126589307
(2,4-diethylphenyl) N-(2,4-dimethylphenyl)carbamate
CID 141368036
N-(4-butyl-2-methylphenyl)-2-methylpropanamide
CID 86731579

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-2-methylphenyl)-3-methylurea?
The IUPAC name of 1-(4-ethyl-2-methylphenyl)-3-methylurea (CID 23348894) is 1-(4-ethyl-2-methylphenyl)-3-methylurea.
What is the SMILES notation for 1-(4-ethyl-2-methylphenyl)-3-methylurea?
The canonical SMILES for 1-(4-ethyl-2-methylphenyl)-3-methylurea is CCc1ccc(NC(=O)NC)c(C)c1.
What is the InChIKey of 1-(4-ethyl-2-methylphenyl)-3-methylurea?
The InChIKey is DBXJFCUTVAGLBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-4-9-5-6-10(8(2)7-9)13-11(14)12-3/h5-7H,4H2,1-3H3,(H2,12,13,14).
What are the key properties of 1-(4-ethyl-2-methylphenyl)-3-methylurea?
1-(4-ethyl-2-methylphenyl)-3-methylurea has a molecular weight of 192.26 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-2-methylphenyl)-3-methylurea is sourced from PubChem (CID 23348894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).