N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide

C11H12ClN5O — CID 107595749

IUPACN-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(C)c1C(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C11H12ClN5O/c1-6-10(7(2)17(3)16-6)11(18)15-9-5-13-8(12)4-14-9/h4-5H,1-3H3,(H,14,15,18)
InChIKeyZGKHVVTVXYRRCV-UHFFFAOYSA-N
MW265.70 g/mol
LogP1.73
Rot. Bonds2

About N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide

N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide (PubChem CID 107595749) has the molecular formula C11H12ClN5O and a molecular weight of 265.70 g/mol. Its IUPAC name is N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide
PubChem CID107595749
Molecular FormulaC11H12ClN5O
Molecular Weight265.70 g/mol
Exact Mass265.07
IUPAC NameN-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(C)c1C(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C11H12ClN5O/c1-6-10(7(2)17(3)16-6)11(18)15-9-5-13-8(12)4-14-9/h4-5H,1-3H3,(H,14,15,18)
InChIKeyZGKHVVTVXYRRCV-UHFFFAOYSA-N
XLogP1.73
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-chloro-4-methyl-3-pyridinyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 113263016
N-(5-chloropyrazin-2-yl)-2,3,4,5,6-pentafluorobenzamide
CID 107595794
N-(3,5-dichloro-4-hydroxyphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 82884303
N-(5-chloropyrazin-2-yl)-1-ethyl-3-methylpyrazole-4-carboxamide
CID 167751137
1,3,5-trimethyl-N-phenylpyrazole-4-carboxamide
CID 19281566
1,3,5-trimethyl-N-(1-methylpyrazol-4-yl)pyrazole-4-carboxamide
CID 32607033
N-hydroxy-1,3,5-trimethylpyrazole-4-carboxamide
CID 28742914
N-(5-chloropyrazin-2-yl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 107595898
N-(6-chloro-3-nitro-2-pyridinyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 104820422
5-chloro-2-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]benzoic acid
CID 28548365
N-(5-chloropyrazin-2-yl)-5-methylthiophene-2-carboxamide
CID 104964172
1,3,5-trimethyl-N-(2,3,5,6-tetrafluorophenyl)pyrazole-4-carboxamide
CID 19281483

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide?
The IUPAC name of N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide (CID 107595749) is N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide is Cc1nn(C)c(C)c1C(=O)Nc1cnc(Cl)cn1.
What is the InChIKey of N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide?
The InChIKey is ZGKHVVTVXYRRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O/c1-6-10(7(2)17(3)16-6)11(18)15-9-5-13-8(12)4-14-9/h4-5H,1-3H3,(H,14,15,18).
What are the key properties of N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide?
N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropyrazin-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide is sourced from PubChem (CID 107595749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).