N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide

C16H20ClN3O — CID 35281504

IUPACN-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(-n2nc(C)c(Cl)c2C)cc1
InChIInChI=1S/C16H20ClN3O/c1-4-5-6-15(21)18-13-7-9-14(10-8-13)20-12(3)16(17)11(2)19-20/h7-10H,4-6H2,1-3H3,(H,18,21)
InChIKeyNYYPQMJMLDOMQD-UHFFFAOYSA-N
MW305.81 g/mol
LogP4.27
Rot. Bonds5

About N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide

N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide (PubChem CID 35281504) has the molecular formula C16H20ClN3O and a molecular weight of 305.81 g/mol. Its IUPAC name is N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide.

Molecular Properties

Compound NameN-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide
PubChem CID35281504
Molecular FormulaC16H20ClN3O
Molecular Weight305.81 g/mol
Exact Mass305.13
IUPAC NameN-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(-n2nc(C)c(Cl)c2C)cc1
InChIInChI=1S/C16H20ClN3O/c1-4-5-6-15(21)18-13-7-9-14(10-8-13)20-12(3)16(17)11(2)19-20/h7-10H,4-6H2,1-3H3,(H,18,21)
InChIKeyNYYPQMJMLDOMQD-UHFFFAOYSA-N
XLogP4.27
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.81
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide 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-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]-3-(1,5-dimethylpyrazol-4-yl)propanamide
CID 35760755
[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 4-(4-chloro-3,5-dimethylpyrazol-1-yl)benzoate
CID 16502089
1-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]-3-(4-methoxyphenyl)urea
CID 35281421
3-bromo-N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]benzamide
CID 35760792
N-(4-methylphenyl)pentanamide
CID 3662375
4-chloro-N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]-1-methylpyrazole-3-carboxamide
CID 35532568
4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-cyanophenyl)benzamide
CID 26289954
4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-methylsulfonylphenyl)benzamide
CID 26239294
4-[4-(4-ethoxycarbonyl-3,5-dimethylpyrazol-1-yl)anilino]-4-oxobutanoic acid
CID 2740661
N-[4-(methylamino)phenyl]pentanamide
CID 71040406
1-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-3-butylurea
CID 35281038
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide?
The IUPAC name of N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide (CID 35281504) is N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide.
What is the SMILES notation for N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide?
The canonical SMILES for N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide is CCCCC(=O)Nc1ccc(-n2nc(C)c(Cl)c2C)cc1.
What is the InChIKey of N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide?
The InChIKey is NYYPQMJMLDOMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O/c1-4-5-6-15(21)18-13-7-9-14(10-8-13)20-12(3)16(17)11(2)19-20/h7-10H,4-6H2,1-3H3,(H,18,21).
What are the key properties of N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide?
N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide has a molecular weight of 305.81 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]pentanamide is sourced from PubChem (CID 35281504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).