N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide

C11H12N4O — CID 139271830

IUPACN-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
SMILESCCc1ccc(NC(=O)c2ccn[nH]2)nc1
InChIInChI=1S/C11H12N4O/c1-2-8-3-4-10(12-7-8)14-11(16)9-5-6-13-15-9/h3-7H,2H2,1H3,(H,13,15)(H,12,14,16)
InChIKeyMCWUBOZNIWWSCH-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.62
Rot. Bonds3

About N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide

N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide (PubChem CID 139271830) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
PubChem CID139271830
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
SMILESCCc1ccc(NC(=O)c2ccn[nH]2)nc1
InChIInChI=1S/C11H12N4O/c1-2-8-3-4-10(12-7-8)14-11(16)9-5-6-13-15-9/h3-7H,2H2,1H3,(H,13,15)(H,12,14,16)
InChIKeyMCWUBOZNIWWSCH-UHFFFAOYSA-N
XLogP1.62
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-pyridinyl)-1H-pyrazole-5-carboxamide
CID 60778171
N-(6-methylpyrazin-2-yl)-1H-pyrazole-5-carboxamide
CID 118062540
N-[3-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]-1H-pyrazole-5-carboxamide
CID 75370264
N-(6-bromo-3-pyridinyl)-1H-pyrazole-5-carboxamide
CID 103789326
N-phenyl-1H-pyrazole-5-carboxamide
CID 680935
N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide
CID 70908062
N-(4-hydroxyphenyl)-1H-pyrazole-5-carboxamide
CID 63078720
N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide
CID 79095429
N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-carboxamide
CID 102989436
N-(4-carbamothioyl-1H-pyrazol-5-yl)-1H-pyrazole-5-carboxamide
CID 79503790
N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide
CID 55063231
N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-1H-pyrazole-5-carboxamide
CID 130354570

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide (CID 139271830) is N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide is CCc1ccc(NC(=O)c2ccn[nH]2)nc1.
What is the InChIKey of N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The InChIKey is MCWUBOZNIWWSCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-2-8-3-4-10(12-7-8)14-11(16)9-5-6-13-15-9/h3-7H,2H2,1H3,(H,13,15)(H,12,14,16).
What are the key properties of N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-2-pyridinyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 139271830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).