N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide

C15H17ClF2N4O — CID 69261186

IUPACN-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide
SMILESCCN(C(=O)CCC(C)(F)F)c1cn(-c2cccnc2)nc1Cl
InChIInChI=1S/C15H17ClF2N4O/c1-3-21(13(23)6-7-15(2,17)18)12-10-22(20-14(12)16)11-5-4-8-19-9-11/h4-5,8-10H,3,6-7H2,1-2H3
InChIKeyDXGNAIYKDISLQA-UHFFFAOYSA-N
MW342.78 g/mol
LogP3.71
Rot. Bonds6

About N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide

N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide (PubChem CID 69261186) has the molecular formula C15H17ClF2N4O and a molecular weight of 342.78 g/mol. Its IUPAC name is N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide.

Molecular Properties

Compound NameN-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide
PubChem CID69261186
Molecular FormulaC15H17ClF2N4O
Molecular Weight342.78 g/mol
Exact Mass342.11
IUPAC NameN-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide
SMILESCCN(C(=O)CCC(C)(F)F)c1cn(-c2cccnc2)nc1Cl
InChIInChI=1S/C15H17ClF2N4O/c1-3-21(13(23)6-7-15(2,17)18)12-10-22(20-14(12)16)11-5-4-8-19-9-11/h4-5,8-10H,3,6-7H2,1-2H3
InChIKeyDXGNAIYKDISLQA-UHFFFAOYSA-N
XLogP3.71
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.78
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide 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,N-dimethyl-1-[4-[4-(trifluoromethyl)pyrazol-1-yl]pyridin-3-yl]piperidine-4-carboxamide
CID 118450657
N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide
CID 118450716
1-(4-(4-chloro-1H-pyrazol-1-yl)pyridin-3-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 118450730
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-pyridin-3-ylacetamide
CID 3236806
US9963443, Reference Example 5
CID 76283990
US9963443, Reference Example 4
CID 118450573
2-(4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)-N-(2-chloropyridin-3-yl)acetamide
CID 1922700
2-(4-Chloro-3,5-dimethyl-pyrazol-1-yl)-1-(4-pyridin-4-yl-piperazin-1-yl)-ethanone
CID 21071057
1-[4-(4-chloropyrazol-1-yl)pyridin-3-yl]-N-cyclopentyl-3,3-difluoropiperidine-4-carboxamide
CID 118450561
2-methyl-3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(pyridin-3-yl)propanamide
CID 4867280
2-(4-Chloro-3,5-dimethylpyrazol-1-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanone
CID 56817554
N-(2-chloro-3-pyridinyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 76320250

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide?
The IUPAC name of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide (CID 69261186) is N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide.
What is the SMILES notation for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide?
The canonical SMILES for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide is CCN(C(=O)CCC(C)(F)F)c1cn(-c2cccnc2)nc1Cl.
What is the InChIKey of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide?
The InChIKey is DXGNAIYKDISLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClF2N4O/c1-3-21(13(23)6-7-15(2,17)18)12-10-22(20-14(12)16)11-5-4-8-19-9-11/h4-5,8-10H,3,6-7H2,1-2H3.
What are the key properties of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide?
N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide has a molecular weight of 342.78 g/mol, XLogP of 3.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-4,4-difluoropentanamide is sourced from PubChem (CID 69261186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).