1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea

C15H23N3O3 — CID 63871420

IUPAC1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea
SMILESCOc1ccc(NC(=O)NCCOC2CCNCC2)cc1
InChIInChI=1S/C15H23N3O3/c1-20-13-4-2-12(3-5-13)18-15(19)17-10-11-21-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H2,17,18,19)
InChIKeyUNGDRNLAQDNAMV-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.59
Rot. Bonds6

About 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea

1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea (PubChem CID 63871420) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea
PubChem CID63871420
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea
SMILESCOc1ccc(NC(=O)NCCOC2CCNCC2)cc1
InChIInChI=1S/C15H23N3O3/c1-20-13-4-2-12(3-5-13)18-15(19)17-10-11-21-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H2,17,18,19)
InChIKeyUNGDRNLAQDNAMV-UHFFFAOYSA-N
XLogP1.59
TPSA71.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-methoxyphenyl)-3-(2-piperidin-2-ylethyl)urea
CID 24703297
1-(3,3-dimethylbutyl)-3-(4-methoxyphenyl)urea
CID 21361439
1-(4-methoxyphenyl)-3-(3-methylbutyl)urea
CID 18884814
1-[2-(4-methoxyphenoxy)ethyl]-3-(4-methylphenyl)urea
CID 51244378
1-butyl-3-(2-piperidin-4-yloxyethyl)urea
CID 55252329
1-dodecyl-3-(4-methoxyphenyl)urea
CID 172727415
1-(6-hydroxyhexyl)-3-(4-methoxyphenyl)urea
CID 103918690
1-[2-(4-aminocyclohexyl)oxyethyl]-3-phenylurea
CID 63869416
2-piperidin-4-yloxy-N-(4-propoxyphenyl)acetamide
CID 63876932
2-fluoro-6-methoxy-N-(2-piperidin-4-yloxyethyl)benzamide
CID 65434238
1-[4-(dimethylamino)phenyl]-3-[2-(4-methoxyphenoxy)ethyl]urea
CID 108894850
1-(4-methoxyphenyl)-3-[2-(4-propan-2-ylphenoxy)ethyl]urea
CID 112972614

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea?
The IUPAC name of 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea (CID 63871420) is 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea.
What is the SMILES notation for 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea?
The canonical SMILES for 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea is COc1ccc(NC(=O)NCCOC2CCNCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea?
The InChIKey is UNGDRNLAQDNAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-20-13-4-2-12(3-5-13)18-15(19)17-10-11-21-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H2,17,18,19).
What are the key properties of 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea?
1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea has a molecular weight of 293.37 g/mol, XLogP of 1.59, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-3-(2-piperidin-4-yloxyethyl)urea is sourced from PubChem (CID 63871420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).