N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide

C17H20N4O — CID 95825784

IUPACN-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(C2CCNCC2)n1
InChIInChI=1S/C17H20N4O/c1-12-4-2-3-5-14(12)21-17(22)16-11-19-10-15(20-16)13-6-8-18-9-7-13/h2-5,10-11,13,18H,6-9H2,1H3,(H,21,22)
InChIKeyFROUFYIAIKKDQC-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.50
Rot. Bonds3

About N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide

N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide (PubChem CID 95825784) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide
PubChem CID95825784
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(C2CCNCC2)n1
InChIInChI=1S/C17H20N4O/c1-12-4-2-3-5-14(12)21-17(22)16-11-19-10-15(20-16)13-6-8-18-9-7-13/h2-5,10-11,13,18H,6-9H2,1H3,(H,21,22)
InChIKeyFROUFYIAIKKDQC-UHFFFAOYSA-N
XLogP2.50
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylphenyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119670454
1-(3,4-dimethylphenyl)-N-(2-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20923975
N-(2-methylphenyl)-2-(piperidin-4-ylmethoxy)acetamide
CID 39062948
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
6-(2-methylanilino)-N-(2H-tetrazol-5-yl)pyrazine-2-carboxamide
CID 14183513
N-(2-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62210327
3-cyclopropyl-N-(2-methylphenyl)-1H-pyrrole-2-carboxamide
CID 70922242
N-(2,3-dimethylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146053304
4,6-dimethyl-N-(2-methylphenyl)pyridine-2-carboxamide
CID 19224338
2-[ethyl(piperidin-4-yl)amino]-N-(2-methylphenyl)acetamide
CID 60805607
6-chloro-N-(4-chloro-2-methylphenyl)pyrazine-2-carboxamide
CID 103336937
6-N-(3-chloro-2-methylphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100060

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide?
The IUPAC name of N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide (CID 95825784) is N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide is Cc1ccccc1NC(=O)c1cncc(C2CCNCC2)n1.
What is the InChIKey of N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide?
The InChIKey is FROUFYIAIKKDQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-12-4-2-3-5-14(12)21-17(22)16-11-19-10-15(20-16)13-6-8-18-9-7-13/h2-5,10-11,13,18H,6-9H2,1H3,(H,21,22).
What are the key properties of N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide?
N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-6-piperidin-4-ylpyrazine-2-carboxamide is sourced from PubChem (CID 95825784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).