N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide

C11H14N4O — CID 112696251

IUPACN-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide
SMILESCn1cc(C#N)c(NC(=O)C2CCCC2)n1
InChIInChI=1S/C11H14N4O/c1-15-7-9(6-12)10(14-15)13-11(16)8-4-2-3-5-8/h7-8H,2-5H2,1H3,(H,13,14,16)
InChIKeyXSDSUPKWUTYEJZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.42
Rot. Bonds2

About N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide

N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide (PubChem CID 112696251) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide
PubChem CID112696251
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide
SMILESCn1cc(C#N)c(NC(=O)C2CCCC2)n1
InChIInChI=1S/C11H14N4O/c1-15-7-9(6-12)10(14-15)13-11(16)8-4-2-3-5-8/h7-8H,2-5H2,1H3,(H,13,14,16)
InChIKeyXSDSUPKWUTYEJZ-UHFFFAOYSA-N
XLogP1.42
TPSA70.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyano-1-methylpyrazol-3-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 113430347
N-(4-cyano-1-methylpyrazol-3-yl)-2-cyclobutylacetamide
CID 103163618
N-(4-cyano-1-methylpyrazol-3-yl)-2-propoxyacetamide
CID 107938878
N-(4-cyano-1-methylpyrazol-3-yl)heptanamide
CID 114752737
N-(4-cyano-1-methylpyrazol-3-yl)octanamide
CID 112696255
N-(4-cyano-1-methylpyrazol-3-yl)-4-(trifluoromethyl)benzamide
CID 115672352
N-(4-cyano-1-methylpyrazol-3-yl)-2,4,5-trimethylfuran-3-carboxamide
CID 104593061
N-(4-cyano-1-methylpyrazol-3-yl)-5-methylpyridine-3-carboxamide
CID 104593096
N-(5-cyano-1,2-dimethylimidazol-4-yl)cyclobutanecarboxamide
CID 134104902
5-bromo-N-(4-cyano-1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 104593149
1-(4-cyano-1-methylpyrazol-3-yl)-3-(3,4-dichlorophenyl)urea
CID 104593247
N-(4-cyano-1-methylpyrazol-3-yl)-2-methyl-1,3-thiazole-5-carboxamide
CID 113248158

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide?
The IUPAC name of N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide (CID 112696251) is N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide is Cn1cc(C#N)c(NC(=O)C2CCCC2)n1.
What is the InChIKey of N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide?
The InChIKey is XSDSUPKWUTYEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15-7-9(6-12)10(14-15)13-11(16)8-4-2-3-5-8/h7-8H,2-5H2,1H3,(H,13,14,16).
What are the key properties of N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide?
N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1-methylpyrazol-3-yl)cyclopentanecarboxamide is sourced from PubChem (CID 112696251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).