1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea

C14H19N5O2 — CID 71860456

IUPAC1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea
SMILESCc1cc(=O)n(C)cc1NC(=O)NCCCn1cccn1
InChIInChI=1S/C14H19N5O2/c1-11-9-13(20)18(2)10-12(11)17-14(21)15-5-3-7-19-8-4-6-16-19/h4,6,8-10H,3,5,7H2,1-2H3,(H2,15,17,21)
InChIKeyLZNZYPSXJIPJSC-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.10
Rot. Bonds5

About 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea

1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea (PubChem CID 71860456) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea.

Molecular Properties

Compound Name1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea
PubChem CID71860456
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea
SMILESCc1cc(=O)n(C)cc1NC(=O)NCCCn1cccn1
InChIInChI=1S/C14H19N5O2/c1-11-9-13(20)18(2)10-12(11)17-14(21)15-5-3-7-19-8-4-6-16-19/h4,6,8-10H,3,5,7H2,1-2H3,(H2,15,17,21)
InChIKeyLZNZYPSXJIPJSC-UHFFFAOYSA-N
XLogP1.10
TPSA80.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)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-(3-methyl-4-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea
CID 75438221
1-(5-chloro-2-fluorophenyl)-3-(3-pyrazol-1-ylpropyl)urea
CID 47199081
5-bromo-1-methyl-2-oxo-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 138028075
1-[2-chloro-5-(diethylsulfamoyl)phenyl]-3-(3-pyrazol-1-ylpropyl)urea
CID 55696278
1-(3-pyrazol-1-ylpropyl)-3-[2-(trifluoromethylsulfanyl)phenyl]urea
CID 87010339
1-(3-pyrazol-1-ylpropyl)-3-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]urea
CID 86931524
3-methyl-N-(3-pyrazol-1-ylpropyl)butanamide
CID 51077805
2-methyl-3-pyrazol-1-yl-N-(3-pyrazol-1-ylpropyl)propanamide
CID 131920894
tert-butyl N-(3-pyrazol-1-ylpropyl)carbamate
CID 69176267
3-methyl-N-(3-pyrazol-1-ylpropyl)benzamide
CID 19332230
1-(1-cyclopropylethyl)-3-(3-pyrazol-1-ylpropyl)urea
CID 47221371
3-methyl-2-(2-pyrazol-1-ylethylcarbamoylamino)benzoic acid
CID 61461235

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea?
The IUPAC name of 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea (CID 71860456) is 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea.
What is the SMILES notation for 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea?
The canonical SMILES for 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea is Cc1cc(=O)n(C)cc1NC(=O)NCCCn1cccn1.
What is the InChIKey of 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea?
The InChIKey is LZNZYPSXJIPJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-11-9-13(20)18(2)10-12(11)17-14(21)15-5-3-7-19-8-4-6-16-19/h4,6,8-10H,3,5,7H2,1-2H3,(H2,15,17,21).
What are the key properties of 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea?
1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea has a molecular weight of 289.34 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethyl-6-oxo-3-pyridinyl)-3-(3-pyrazol-1-ylpropyl)urea is sourced from PubChem (CID 71860456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).