N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide

C17H15ClF2N6O — CID 155960964

IUPACN-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide
SMILESO=C(Cn1nc(C(F)F)c2c1CCC2)Nc1ccn(-c2ncccc2Cl)n1
InChIInChI=1S/C17H15ClF2N6O/c18-11-4-2-7-21-17(11)25-8-6-13(23-25)22-14(27)9-26-12-5-1-3-10(12)15(24-26)16(19)20/h2,4,6-8,16H,1,3,5,9H2,(H,22,23,27)
InChIKeyPJSSAPYUHMUYBL-UHFFFAOYSA-N
MW392.80 g/mol
LogP3.18
Rot. Bonds5

About N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide

N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide (PubChem CID 155960964) has the molecular formula C17H15ClF2N6O and a molecular weight of 392.80 g/mol. Its IUPAC name is N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide
PubChem CID155960964
Molecular FormulaC17H15ClF2N6O
Molecular Weight392.80 g/mol
Exact Mass392.10
IUPAC NameN-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide
SMILESO=C(Cn1nc(C(F)F)c2c1CCC2)Nc1ccn(-c2ncccc2Cl)n1
InChIInChI=1S/C17H15ClF2N6O/c18-11-4-2-7-21-17(11)25-8-6-13(23-25)22-14(27)9-26-12-5-1-3-10(12)15(24-26)16(19)20/h2,4,6-8,16H,1,3,5,9H2,(H,22,23,27)
InChIKeyPJSSAPYUHMUYBL-UHFFFAOYSA-N
XLogP3.18
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.80
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide 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-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110016655
N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-fluorospiro[2.3]hexane-5-carboxamide
CID 155957425
2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 51853304
1-(3-chloro-2-pyridinyl)-N-methylpyrazol-3-amine
CID 130684274
2,4-dichloro-N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]benzamide
CID 99626160
N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-5-propan-2-ylpyridine-2-carboxamide
CID 155948532
3-chloro-2-[3-(difluoromethyl)pyrazol-1-yl]pyridine
CID 141187015
N-pyridin-2-yl-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide
CID 58267378
2-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-N-(1-methylpyrazol-3-yl)acetamide
CID 91842692
N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-1-methyl-5-propylpyrazole-3-carboxamide
CID 155958138
N-[4-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]phenyl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide
CID 124837427
2-[4-chloro-5-cyclopropyl-3-(difluoromethyl)pyrazol-1-yl]-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-3-yl]acetamide
CID 19526870

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide?
The IUPAC name of N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide (CID 155960964) is N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide.
What is the SMILES notation for N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide?
The canonical SMILES for N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide is O=C(Cn1nc(C(F)F)c2c1CCC2)Nc1ccn(-c2ncccc2Cl)n1.
What is the InChIKey of N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide?
The InChIKey is PJSSAPYUHMUYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClF2N6O/c18-11-4-2-7-21-17(11)25-8-6-13(23-25)22-14(27)9-26-12-5-1-3-10(12)15(24-26)16(19)20/h2,4,6-8,16H,1,3,5,9H2,(H,22,23,27).
What are the key properties of N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide?
N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide has a molecular weight of 392.80 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chloro-2-pyridinyl)pyrazol-3-yl]-2-[3-(difluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide is sourced from PubChem (CID 155960964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).