N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide

C17H19F2N3O2 — CID 134699182

IUPACN-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide
SMILESCc1cnn(C2CCCC2)c1NC(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C17H19F2N3O2/c1-11-10-20-22(13-4-2-3-5-13)15(11)21-16(23)12-6-8-14(9-7-12)24-17(18)19/h6-10,13,17H,2-5H2,1H3,(H,21,23)
InChIKeyMJHIYEDSYDFIHN-UHFFFAOYSA-N
MW335.35 g/mol
LogP4.16
Rot. Bonds5

About N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide

N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide (PubChem CID 134699182) has the molecular formula C17H19F2N3O2 and a molecular weight of 335.35 g/mol. Its IUPAC name is N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide.

Molecular Properties

Compound NameN-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide
PubChem CID134699182
Molecular FormulaC17H19F2N3O2
Molecular Weight335.35 g/mol
Exact Mass335.14
IUPAC NameN-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide
SMILESCc1cnn(C2CCCC2)c1NC(=O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C17H19F2N3O2/c1-11-10-20-22(13-4-2-3-5-13)15(11)21-16(23)12-6-8-14(9-7-12)24-17(18)19/h6-10,13,17H,2-5H2,1H3,(H,21,23)
InChIKeyMJHIYEDSYDFIHN-UHFFFAOYSA-N
XLogP4.16
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.35
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyclopentyl-4-methylpyrazol-5-yl)-3-methyl-4-oxoquinazoline-7-carboxamide
CID 134697033
N-(1-cyclopentyl-4-methylpyrazol-5-yl)-8-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 134704612
4-(difluoromethoxy)-N-(2,4-dimethylphenyl)benzamide
CID 1224653
2-cyclohexyl-N-[4-(difluoromethoxy)phenyl]-1,3-dioxoisoindole-5-carboxamide
CID 8502606
N-(4-acetamidophenyl)-4-(difluoromethoxy)benzamide
CID 2168312
4-(difluoromethoxy)-N-(3-iodo-4-methylphenyl)benzamide
CID 2676650
4-(difluoromethoxy)-N-(4-piperidin-1-ylphenyl)benzamide
CID 3928894
N-(2-amino-1-cyclopentylethyl)-4-(difluoromethoxy)benzamide
CID 106737206
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide
CID 172674373
N-(2-chlorocyclopentyl)-4-(difluoromethoxy)benzamide
CID 106443998
ethyl 4-[[4-(difluoromethoxy)benzoyl]amino]benzoate
CID 2677138

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide?
The IUPAC name of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide (CID 134699182) is N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide.
What is the SMILES notation for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide?
The canonical SMILES for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide is Cc1cnn(C2CCCC2)c1NC(=O)c1ccc(OC(F)F)cc1.
What is the InChIKey of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide?
The InChIKey is MJHIYEDSYDFIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F2N3O2/c1-11-10-20-22(13-4-2-3-5-13)15(11)21-16(23)12-6-8-14(9-7-12)24-17(18)19/h6-10,13,17H,2-5H2,1H3,(H,21,23).
What are the key properties of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide?
N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide has a molecular weight of 335.35 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-4-(difluoromethoxy)benzamide is sourced from PubChem (CID 134699182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).