N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide

C15H18N4O — CID 71807892

IUPACN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide
SMILESO=C(NCCn1ccc(-c2ccccn2)n1)C1CCC1
InChIInChI=1S/C15H18N4O/c20-15(12-4-3-5-12)17-9-11-19-10-7-14(18-19)13-6-1-2-8-16-13/h1-2,6-8,10,12H,3-5,9,11H2,(H,17,20)
InChIKeyPSHYSAVZGHSRJW-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.86
Rot. Bonds5

About N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide

N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide (PubChem CID 71807892) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide
PubChem CID71807892
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide
SMILESO=C(NCCn1ccc(-c2ccccn2)n1)C1CCC1
InChIInChI=1S/C15H18N4O/c20-15(12-4-3-5-12)17-9-11-19-10-7-14(18-19)13-6-1-2-8-16-13/h1-2,6-8,10,12H,3-5,9,11H2,(H,17,20)
InChIKeyPSHYSAVZGHSRJW-UHFFFAOYSA-N
XLogP1.86
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-methyl-1H-pyrazol-1-yl)-N'-[(E)-(6-methylpyridin-2-yl)methylidene]acetohydrazide
CID 6879191
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-pyridin-2-ylmethylidene]acetohydrazide
CID 6889248
N-[2-(1-phenyl-1H-pyrazol-3-yl)ethyl]cyclohexanecarboxamide
CID 47092747
N-(1-phenylpyrazol-4-yl)-2-(3-pyridin-2-ylpyrazol-1-yl)acetamide
CID 141484735
N-(pyridin-2-ylmethyl)-2-(4,5,6,7-tetrahydroindazol-2-yl)acetamide
CID 5309885
(5S)-5-{[{[3-(2-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]methyl}(pyridin-2-ylmethyl)amino]methyl}pyrrolidin-2-one
CID 16190975
N-(4-pyrazol-1-ylphenyl)-1-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 24791954
N-((1S)-1-phenyl-3-(4-(4-(pyridin-4-yl)-1H-pyrazol-5-yl)piperidin-1-yl)butyl)cyclobutanecarboxamide
CID 44590865
(2S)-2-[(1-methylpyrazol-3-yl)methylamino]-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide
CID 71456911
5-tert-butyl-1-pentyl-N-pyridin-4-ylpyrazole-3-carboxamide
CID 162668719
N,N-dimethyl-1-[4-(3-methylpyrazol-1-yl)-3-pyridinyl]piperidine-4-carboxamide
CID 118450576
N-[2-(3-phenylpyrazol-1-yl)ethyl]cyclopentanecarboxamide
CID 123225257

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide?
The IUPAC name of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide (CID 71807892) is N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide?
The canonical SMILES for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide is O=C(NCCn1ccc(-c2ccccn2)n1)C1CCC1.
What is the InChIKey of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide?
The InChIKey is PSHYSAVZGHSRJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(12-4-3-5-12)17-9-11-19-10-7-14(18-19)13-6-1-2-8-16-13/h1-2,6-8,10,12H,3-5,9,11H2,(H,17,20).
What are the key properties of N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide?
N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]cyclobutanecarboxamide is sourced from PubChem (CID 71807892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).