(4,5-dimethoxy-2-methylphenyl)urea

C10H14N2O3 — CID 82492626

IUPAC(4,5-dimethoxy-2-methylphenyl)urea
SMILESCOc1cc(C)c(NC(N)=O)cc1OC
InChIInChI=1S/C10H14N2O3/c1-6-4-8(14-2)9(15-3)5-7(6)12-10(11)13/h4-5H,1-3H3,(H3,11,12,13)
InChIKeyCKQBKJMLBNCLPX-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.50
Rot. Bonds3

About (4,5-dimethoxy-2-methylphenyl)urea

(4,5-dimethoxy-2-methylphenyl)urea (PubChem CID 82492626) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is (4,5-dimethoxy-2-methylphenyl)urea.

Molecular Properties

Compound Name(4,5-dimethoxy-2-methylphenyl)urea
PubChem CID82492626
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name(4,5-dimethoxy-2-methylphenyl)urea
SMILESCOc1cc(C)c(NC(N)=O)cc1OC
InChIInChI=1S/C10H14N2O3/c1-6-4-8(14-2)9(15-3)5-7(6)12-10(11)13/h4-5H,1-3H3,(H3,11,12,13)
InChIKeyCKQBKJMLBNCLPX-UHFFFAOYSA-N
XLogP1.50
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 54996224
methyl 2-(4,5-dimethoxy-2-methylanilino)propanoate
CID 60666932
(4-ethoxy-2,5-dimethylphenyl)urea
CID 82492490
(2S)-2-amino-N-(4,5-dimethoxy-2-methylphenyl)butanamide
CID 79024477
2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide
CID 79796473
ethyl 4-(4,5-dimethoxy-2-methylanilino)-4-oxobutanoate
CID 28538834
ethane;(2-methoxy-5-methylphenyl)urea
CID 142042876
3-amino-4-(4,5-dimethoxy-2-methylanilino)-4-oxobutanoic acid
CID 64895496
5-amino-N-(4,5-dimethoxy-2-methylphenyl)-4-methylpentanamide
CID 82012097
2-[(4,5-dimethoxy-2-methylphenyl)carbamoylamino]acetic acid
CID 82501882
[2-[(2-methoxy-4,5-dimethylphenyl)diazenyl]-5-methylphenyl]urea
CID 157197459
N-(4,5-dimethoxy-2-methylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 7751153

Frequently Asked Questions

What is the IUPAC name of (4,5-dimethoxy-2-methylphenyl)urea?
The IUPAC name of (4,5-dimethoxy-2-methylphenyl)urea (CID 82492626) is (4,5-dimethoxy-2-methylphenyl)urea.
What is the SMILES notation for (4,5-dimethoxy-2-methylphenyl)urea?
The canonical SMILES for (4,5-dimethoxy-2-methylphenyl)urea is COc1cc(C)c(NC(N)=O)cc1OC.
What is the InChIKey of (4,5-dimethoxy-2-methylphenyl)urea?
The InChIKey is CKQBKJMLBNCLPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-4-8(14-2)9(15-3)5-7(6)12-10(11)13/h4-5H,1-3H3,(H3,11,12,13).
What are the key properties of (4,5-dimethoxy-2-methylphenyl)urea?
(4,5-dimethoxy-2-methylphenyl)urea has a molecular weight of 210.23 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dimethoxy-2-methylphenyl)urea is sourced from PubChem (CID 82492626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).