2-[(2-methoxyphenyl)methylamino]ethylurea

C11H17N3O2 — CID 83109260

IUPAC2-[(2-methoxyphenyl)methylamino]ethylurea
SMILESCOc1ccccc1CNCCNC(N)=O
InChIInChI=1S/C11H17N3O2/c1-16-10-5-3-2-4-9(10)8-13-6-7-14-11(12)15/h2-5,13H,6-8H2,1H3,(H3,12,14,15)
InChIKeyOUPJHZYXAFWGTB-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.45
Rot. Bonds6

About 2-[(2-methoxyphenyl)methylamino]ethylurea

2-[(2-methoxyphenyl)methylamino]ethylurea (PubChem CID 83109260) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methylamino]ethylurea.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methylamino]ethylurea
PubChem CID83109260
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[(2-methoxyphenyl)methylamino]ethylurea
SMILESCOc1ccccc1CNCCNC(N)=O
InChIInChI=1S/C11H17N3O2/c1-16-10-5-3-2-4-9(10)8-13-6-7-14-11(12)15/h2-5,13H,6-8H2,1H3,(H3,12,14,15)
InChIKeyOUPJHZYXAFWGTB-UHFFFAOYSA-N
XLogP0.45
TPSA76.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[(2-methoxyphenyl)methylamino]ethylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-[(2-methoxyphenyl)methylamino]ethyl]-1,1-dimethylurea
CID 83116563
methyl 2-[2-[[2-(carbamoylamino)ethylamino]methyl]phenyl]acetate
CID 83113830
4-[(2-methoxyphenyl)methylamino]butanamide
CID 60863188
2-[[2-(difluoromethoxy)phenyl]methylamino]ethylurea
CID 83109474
2-[(5-bromo-2-methoxyphenyl)methylamino]ethylurea
CID 83111448
2-[2-[(2-methoxyphenyl)methylamino]ethylamino]ethanol;dihydrochloride
CID 17294920
N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide
CID 108998011
5-[(2-methoxyphenyl)methylamino]pentyl acetate
CID 82533082
1-[(2-methoxyphenyl)methyl]-3-propylurea
CID 94828368
N'-(2-amino-2-sulfanylideneethyl)-N-[(2-methoxyphenyl)methyl]oxamide
CID 43316152
1-ethyl-3-[(2-methoxyphenyl)methyl]urea
CID 38151032
tert-butyl N-[(2-methoxyphenyl)methyl]carbamate;hydrochloride
CID 174676513

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methylamino]ethylurea?
The IUPAC name of 2-[(2-methoxyphenyl)methylamino]ethylurea (CID 83109260) is 2-[(2-methoxyphenyl)methylamino]ethylurea.
What is the SMILES notation for 2-[(2-methoxyphenyl)methylamino]ethylurea?
The canonical SMILES for 2-[(2-methoxyphenyl)methylamino]ethylurea is COc1ccccc1CNCCNC(N)=O.
What is the InChIKey of 2-[(2-methoxyphenyl)methylamino]ethylurea?
The InChIKey is OUPJHZYXAFWGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-16-10-5-3-2-4-9(10)8-13-6-7-14-11(12)15/h2-5,13H,6-8H2,1H3,(H3,12,14,15).
What are the key properties of 2-[(2-methoxyphenyl)methylamino]ethylurea?
2-[(2-methoxyphenyl)methylamino]ethylurea has a molecular weight of 223.28 g/mol, XLogP of 0.45, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methylamino]ethylurea is sourced from PubChem (CID 83109260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).