N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide

C16H18FN3O — CID 134798522

IUPACN-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide
SMILESCn1nc(C2CCCC2)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H18FN3O/c1-20-15(10-14(19-20)11-4-2-3-5-11)18-16(21)12-6-8-13(17)9-7-12/h6-11H,2-5H2,1H3,(H,18,21)
InChIKeyIYGLBSBESKEYMV-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.47
Rot. Bonds3

About N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide

N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide (PubChem CID 134798522) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide
PubChem CID134798522
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide
SMILESCn1nc(C2CCCC2)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H18FN3O/c1-20-15(10-14(19-20)11-4-2-3-5-11)18-16(21)12-6-8-13(17)9-7-12/h6-11H,2-5H2,1H3,(H,18,21)
InChIKeyIYGLBSBESKEYMV-UHFFFAOYSA-N
XLogP3.47
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyclopentyl-1-methylpyrazol-5-yl)-5-hydroxypyridine-3-carboxamide
CID 75484361
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N-(3-cyclobutyl-1-methylpyrazol-5-yl)-1-(2,4-difluorophenyl)-5-methylpyrazole-3-carboxamide
CID 99632374
N-(3-cyclohexyl-1-methylpyrazol-5-yl)piperidine-4-carboxamide
CID 119337707
N-(3-cyclopropyl-1-methylpyrazol-5-yl)-5-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
CID 44824708
(2S)-2-amino-N-(3-cyclohexyl-1-methylpyrazol-5-yl)propanamide
CID 119337699
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-phenylacetamide
CID 134799695
N-(3-cyclopropyl-1-methylpyrazol-5-yl)-3-methoxybenzamide
CID 134797678
N-(3-cyclohexyl-1-methylpyrazol-5-yl)-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 139007809
(3-cyclopropyl-1-methylpyrazol-5-yl)carbamic acid
CID 69157729
4-acetamido-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)benzamide
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CID 136564832

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide?
The IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide (CID 134798522) is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide.
What is the SMILES notation for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide?
The canonical SMILES for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide is Cn1nc(C2CCCC2)cc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide?
The InChIKey is IYGLBSBESKEYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-20-15(10-14(19-20)11-4-2-3-5-11)18-16(21)12-6-8-13(17)9-7-12/h6-11H,2-5H2,1H3,(H,18,21).
What are the key properties of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide?
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide has a molecular weight of 287.34 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-4-fluorobenzamide is sourced from PubChem (CID 134798522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).