N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide

C11H19N3O2 — CID 112672114

IUPACN-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide
SMILESCc1nn(C)cc1CNC(=O)CCCCO
InChIInChI=1S/C11H19N3O2/c1-9-10(8-14(2)13-9)7-12-11(16)5-3-4-6-15/h8,15H,3-7H2,1-2H3,(H,12,16)
InChIKeyNHGXGGPIGMOXJY-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.51
Rot. Bonds6

About N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide

N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide (PubChem CID 112672114) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide.

Molecular Properties

Compound NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide
PubChem CID112672114
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide
SMILESCc1nn(C)cc1CNC(=O)CCCCO
InChIInChI=1S/C11H19N3O2/c1-9-10(8-14(2)13-9)7-12-11(16)5-3-4-6-15/h8,15H,3-7H2,1-2H3,(H,12,16)
InChIKeyNHGXGGPIGMOXJY-UHFFFAOYSA-N
XLogP0.51
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide 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

5-chloro-N-[(1,3-dimethylpyrazol-4-yl)methyl]pentanamide
CID 112668674
N-[(1,3-dimethylpyrazol-4-yl)methyl]pentanamide
CID 42352342
N-[(1,3-dimethylpyrazol-4-yl)methyl]acetamide;ethane
CID 142558548
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenylacetamide
CID 19288393
N-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(5-methylpyrazol-1-yl)propanamide
CID 19569842
2-(2-aminophenyl)-N-[(1,3-dimethylpyrazol-4-yl)methyl]acetamide
CID 112668170
5-[(1,3-dimethylpyrazol-4-yl)methylamino]pentanoic acid
CID 103263035
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1,5-dimethylpyrazole-3-carboxamide
CID 19279610
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenoxyacetamide
CID 42352426
4-[(1,3-dimethylpyrazol-4-yl)methylamino]butanoic acid
CID 83088801
5-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]-5-oxopentanoic acid
CID 112668369
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(3-methyl-4-nitropyrazol-1-yl)acetamide
CID 19522147

Frequently Asked Questions

What is the IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide?
The IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide (CID 112672114) is N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide.
What is the SMILES notation for N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide?
The canonical SMILES for N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide is Cc1nn(C)cc1CNC(=O)CCCCO.
What is the InChIKey of N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide?
The InChIKey is NHGXGGPIGMOXJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-9-10(8-14(2)13-9)7-12-11(16)5-3-4-6-15/h8,15H,3-7H2,1-2H3,(H,12,16).
What are the key properties of N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide?
N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide has a molecular weight of 225.29 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-hydroxypentanamide is sourced from PubChem (CID 112672114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).