N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide

C16H16Cl2N4O — CID 109274620

IUPACN-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C16H16Cl2N4O/c17-11-6-12(18)8-13(7-11)21-16(23)14-9-20-15(10-19-14)22-4-2-1-3-5-22/h6-10H,1-5H2,(H,21,23)
InChIKeyKEVFVXQZUSLURW-UHFFFAOYSA-N
MW351.24 g/mol
LogP4.03
Rot. Bonds3

About N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide

N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide (PubChem CID 109274620) has the molecular formula C16H16Cl2N4O and a molecular weight of 351.24 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
PubChem CID109274620
Molecular FormulaC16H16Cl2N4O
Molecular Weight351.24 g/mol
Exact Mass350.07
IUPAC NameN-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C16H16Cl2N4O/c17-11-6-12(18)8-13(7-11)21-16(23)14-9-20-15(10-19-14)22-4-2-1-3-5-22/h6-10H,1-5H2,(H,21,23)
InChIKeyKEVFVXQZUSLURW-UHFFFAOYSA-N
XLogP4.03
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(azepan-1-yl)-N-(4-chlorophenyl)pyrazine-2-carboxamide
CID 109289339
5-(4-acetylpiperazin-1-yl)-N-(3,5-dichlorophenyl)pyrazine-2-carboxamide
CID 109279284
5-(azepan-1-yl)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109289329
N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274621
5-(azepan-1-yl)-N-[4-(dimethylamino)phenyl]pyrazine-2-carboxamide
CID 109289373
5-(azepan-1-yl)-N-(3,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109289360
5-(azepan-1-yl)-N-(3-cyanophenyl)pyrazine-2-carboxamide
CID 109289409
methyl 3-[(5-piperidin-1-ylpyrazine-2-carbonyl)amino]benzoate
CID 109274586
N-(3,5-dimethylphenyl)-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278323
5-(azepan-1-yl)-N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109289319
N-(3-chlorophenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109286633
5-(4-acetylpiperazin-1-yl)-N-(4-chlorophenyl)pyrazine-2-carboxamide
CID 109279241

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide (CID 109274620) is N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(N2CCCCC2)cn1.
What is the InChIKey of N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The InChIKey is KEVFVXQZUSLURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O/c17-11-6-12(18)8-13(7-11)21-16(23)14-9-20-15(10-19-14)22-4-2-1-3-5-22/h6-10H,1-5H2,(H,21,23).
What are the key properties of N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide has a molecular weight of 351.24 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109274620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).