1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea

C20H24N2O2 — CID 113213849

IUPAC1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea
SMILESCOc1cccc(CCNC(=O)NCC2(c3ccccc3)CC2)c1
InChIInChI=1S/C20H24N2O2/c1-24-18-9-5-6-16(14-18)10-13-21-19(23)22-15-20(11-12-20)17-7-3-2-4-8-17/h2-9,14H,10-13,15H2,1H3,(H2,21,22,23)
InChIKeyQPLNEEWHGKQBGX-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.27
Rot. Bonds7

About 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea

1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea (PubChem CID 113213849) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea.

Molecular Properties

Compound Name1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea
PubChem CID113213849
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea
SMILESCOc1cccc(CCNC(=O)NCC2(c3ccccc3)CC2)c1
InChIInChI=1S/C20H24N2O2/c1-24-18-9-5-6-16(14-18)10-13-21-19(23)22-15-20(11-12-20)17-7-3-2-4-8-17/h2-9,14H,10-13,15H2,1H3,(H2,21,22,23)
InChIKeyQPLNEEWHGKQBGX-UHFFFAOYSA-N
XLogP3.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea 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

methyl 3-[2-(3-methoxyphenyl)ethylcarbamoylamino]propanoate
CID 108901083
4-[[[1-(3-methoxyphenyl)cyclopropyl]methylcarbamoylamino]methyl]benzoic acid
CID 122014637
1-[2-(3-hydroxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 60602886
1-[[1-(3-fluorophenyl)cyclopropyl]methyl]-3-[2-(3-methoxyphenyl)ethyl]-2-methylguanidine
CID 111638310
1-[2-(4-methoxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 51290894
phenyl N-[2-(3-methoxyphenyl)ethyl]carbamate
CID 110755565
3-[2-(3-methoxyphenyl)ethylcarbamoylamino]-2,2-dimethylpropanoic acid
CID 107843109
1-[[1-(4-chlorophenyl)cyclopropyl]methyl]-3-[2-(3-chlorophenyl)ethyl]urea
CID 113214484
2-hydroxy-4-[2-(3-methoxyphenyl)ethylcarbamoylamino]butanoic acid
CID 107843133
1-[(4-fluorophenyl)methyl]-3-[2-(3-methoxyphenyl)ethyl]urea
CID 108867745
N-[2-(3-methoxyphenyl)ethyl]-N'-phenyloxamide
CID 44892117
1-amino-N-[2-(3-methoxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119711038

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea?
The IUPAC name of 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea (CID 113213849) is 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea.
What is the SMILES notation for 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea?
The canonical SMILES for 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea is COc1cccc(CCNC(=O)NCC2(c3ccccc3)CC2)c1.
What is the InChIKey of 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea?
The InChIKey is QPLNEEWHGKQBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-18-9-5-6-16(14-18)10-13-21-19(23)22-15-20(11-12-20)17-7-3-2-4-8-17/h2-9,14H,10-13,15H2,1H3,(H2,21,22,23).
What are the key properties of 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea?
1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea has a molecular weight of 324.42 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxyphenyl)ethyl]-3-[(1-phenylcyclopropyl)methyl]urea is sourced from PubChem (CID 113213849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).