1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine

C18H25N3O — CID 3070797

IUPAC1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine
SMILESCc1c(OCCCN2CCCCC2)n[nH]c1-c1ccccc1
InChIInChI=1S/C18H25N3O/c1-15-17(16-9-4-2-5-10-16)19-20-18(15)22-14-8-13-21-11-6-3-7-12-21/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,19,20)
InChIKeyARNMIOZTOPESRU-UHFFFAOYSA-N
MW299.42 g/mol
LogP3.64
Rot. Bonds6

About 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine

1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine (PubChem CID 3070797) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine.

Molecular Properties

Compound Name1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine
PubChem CID3070797
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC Name1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine
SMILESCc1c(OCCCN2CCCCC2)n[nH]c1-c1ccccc1
InChIInChI=1S/C18H25N3O/c1-15-17(16-9-4-2-5-10-16)19-20-18(15)22-14-8-13-21-11-6-3-7-12-21/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,19,20)
InChIKeyARNMIOZTOPESRU-UHFFFAOYSA-N
XLogP3.64
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine 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

4-[2-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]ethyl]morpholine
CID 3070778
1-[3-(4-phenylphenoxy)propyl]piperidine
CID 56683751
2-methyl-4-phenyl-6-(3-piperidin-1-ylpropoxy)-1,3,5-triazine
CID 21256754
4-[4-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-pyrazol-5-yl]phenol
CID 175208942
2-phenyl-4-(3-pyrrolidin-1-ylpropoxy)-5,6,7,8-tetrahydroquinazoline
CID 118723359
1-[6-(4-phenylphenoxy)hexyl]piperidine
CID 155533744
4-(4-fluorophenyl)-5-methyl-6-(4-piperidin-1-ylbutoxy)pyrimidine
CID 21256782
5-methyl-3-[4-(3-piperidin-1-ylpropoxy)phenyl]-1H-pyridazin-6-one
CID 59651971
5-(azepan-1-yl)-N-[5-(4-methoxyphenyl)-4-methyl-1H-pyrazol-3-yl]pentanamide
CID 24998042
N-[5-(4-methoxyphenyl)-4-methyl-1H-pyrazol-3-yl]-4-piperidin-1-ylbutanamide
CID 59174000
1-[5-(4-phenylphenoxy)pentyl]pyrrolidine
CID 11857856
1-[3-(2-ethylphenoxy)propyl]pyrrolidine
CID 2262767

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine?
The IUPAC name of 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine (CID 3070797) is 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine.
What is the SMILES notation for 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine?
The canonical SMILES for 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine is Cc1c(OCCCN2CCCCC2)n[nH]c1-c1ccccc1.
What is the InChIKey of 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine?
The InChIKey is ARNMIOZTOPESRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-15-17(16-9-4-2-5-10-16)19-20-18(15)22-14-8-13-21-11-6-3-7-12-21/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,19,20).
What are the key properties of 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine?
1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine has a molecular weight of 299.42 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propyl]piperidine is sourced from PubChem (CID 3070797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).