1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea

C16H19N3O2 — CID 63767864

IUPAC1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(CN)c1ccccc1
InChIInChI=1S/C16H19N3O2/c1-21-15-10-6-5-9-13(15)18-16(20)19-14(11-17)12-7-3-2-4-8-12/h2-10,14H,11,17H2,1H3,(H2,18,19,20)
InChIKeyMXUTTXUTGRJJAJ-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.52
Rot. Bonds5

About 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea

1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea (PubChem CID 63767864) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea
PubChem CID63767864
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(CN)c1ccccc1
InChIInChI=1S/C16H19N3O2/c1-21-15-10-6-5-9-13(15)18-16(20)19-14(11-17)12-7-3-2-4-8-12/h2-10,14H,11,17H2,1H3,(H2,18,19,20)
InChIKeyMXUTTXUTGRJJAJ-UHFFFAOYSA-N
XLogP2.52
TPSA76.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)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

1-(2-methoxyphenyl)-3-[1-phenyl-2-(triazol-2-yl)ethyl]urea
CID 121176489
1-(2-methoxyphenyl)-3-[1-(4-methoxyphenyl)propyl]urea
CID 78798433
1-(2-methoxyphenyl)-3-[1-(4-methylphenyl)propyl]urea
CID 133204326
1-(2-methoxyphenyl)-3-propan-2-ylurea
CID 19167870
1-(2-methoxyphenyl)-3-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]urea
CID 100747414
N-(2-amino-1-phenylethyl)-2-fluoro-6-methoxybenzamide
CID 65432150
2-[(2-methoxyphenyl)carbamoylamino]-3-phenyl-N-(1-phenylethyl)propanamide
CID 42701995
2-[(2-methoxyphenyl)carbamoylamino]butanoic acid
CID 43469980
4-amino-2-[(2-methoxyphenyl)carbamoylamino]-4-oxobutanoic acid
CID 16776649
N-(2-amino-1-phenylethyl)-2-hydroxy-3-methoxybenzamide
CID 63753586
(3S)-3-acetamido-N-(2-methoxyphenyl)-3-phenylpropanamide
CID 41075346
1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea
CID 43417318

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea (CID 63767864) is 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea is COc1ccccc1NC(=O)NC(CN)c1ccccc1.
What is the InChIKey of 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea?
The InChIKey is MXUTTXUTGRJJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-21-15-10-6-5-9-13(15)18-16(20)19-14(11-17)12-7-3-2-4-8-12/h2-10,14H,11,17H2,1H3,(H2,18,19,20).
What are the key properties of 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea?
1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea has a molecular weight of 285.35 g/mol, XLogP of 2.52, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-1-phenylethyl)-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 63767864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).