1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea

C25H29N3O3 — CID 112817994

IUPAC1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea
SMILESO=C(NCCOc1ccc2ccccc2c1)NC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C25H29N3O3/c29-25(26-12-15-31-23-11-10-20-6-4-5-9-22(20)18-23)27-24(21-7-2-1-3-8-21)19-28-13-16-30-17-14-28/h1-11,18,24H,12-17,19H2,(H2,26,27,29)
InChIKeyDHKIMTXVQMJQGO-UHFFFAOYSA-N
MW419.53 g/mol
LogP3.59
Rot. Bonds8

About 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea

1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea (PubChem CID 112817994) has the molecular formula C25H29N3O3 and a molecular weight of 419.53 g/mol. Its IUPAC name is 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea.

Molecular Properties

Compound Name1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea
PubChem CID112817994
Molecular FormulaC25H29N3O3
Molecular Weight419.53 g/mol
Exact Mass419.22
IUPAC Name1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea
SMILESO=C(NCCOc1ccc2ccccc2c1)NC(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C25H29N3O3/c29-25(26-12-15-31-23-11-10-20-6-4-5-9-22(20)18-23)27-24(21-7-2-1-3-8-21)19-28-13-16-30-17-14-28/h1-11,18,24H,12-17,19H2,(H2,26,27,29)
InChIKeyDHKIMTXVQMJQGO-UHFFFAOYSA-N
XLogP3.59
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.53
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)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

N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-naphthalen-2-yloxyacetamide
CID 9144499
2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9148831
1-[2-(3-chlorophenyl)ethyl]-3-(2-morpholin-4-yl-1-phenylethyl)urea
CID 42954314
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-2-(4-phenylphenoxy)acetamide
CID 9149042
1-(2-methyl-2-phenylpropyl)-3-(2-morpholin-4-yl-1-phenylethyl)urea
CID 78860899
N-(2-morpholin-4-yl-1-phenylethyl)-2-naphthalen-1-ylacetamide
CID 18166740
2-(3-methylphenoxy)-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9148983
3-ethoxy-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 39835171
1-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-(2-morpholin-4-yl-1-phenylethyl)urea
CID 112834684
1-[(5-bromothiophen-2-yl)methyl]-3-(2-morpholin-4-yl-1-phenylethyl)urea
CID 112818589
4-ethoxy-N-[2-[[(1R)-2-morpholin-4-yl-1-phenylethyl]amino]-2-oxoethyl]benzamide
CID 9149139

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea?
The IUPAC name of 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea (CID 112817994) is 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea.
What is the SMILES notation for 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea?
The canonical SMILES for 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea is O=C(NCCOc1ccc2ccccc2c1)NC(CN1CCOCC1)c1ccccc1.
What is the InChIKey of 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea?
The InChIKey is DHKIMTXVQMJQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O3/c29-25(26-12-15-31-23-11-10-20-6-4-5-9-22(20)18-23)27-24(21-7-2-1-3-8-21)19-28-13-16-30-17-14-28/h1-11,18,24H,12-17,19H2,(H2,26,27,29).
What are the key properties of 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea?
1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea has a molecular weight of 419.53 g/mol, XLogP of 3.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-yl-1-phenylethyl)-3-(2-naphthalen-2-yloxyethyl)urea is sourced from PubChem (CID 112817994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).