N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide

C16H16Cl2N4O — CID 109274621

IUPACN-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C16H16Cl2N4O/c17-11-5-4-6-12(18)15(11)21-16(23)13-9-20-14(10-19-13)22-7-2-1-3-8-22/h4-6,9-10H,1-3,7-8H2,(H,21,23)
InChIKeyVEPBVSOBVLDORD-UHFFFAOYSA-N
MW351.24 g/mol
LogP4.03
Rot. Bonds3

About N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide

N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide (PubChem CID 109274621) has the molecular formula C16H16Cl2N4O and a molecular weight of 351.24 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
PubChem CID109274621
Molecular FormulaC16H16Cl2N4O
Molecular Weight351.24 g/mol
Exact Mass350.07
IUPAC NameN-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C16H16Cl2N4O/c17-11-5-4-6-12(18)15(11)21-16(23)13-9-20-14(10-19-13)22-7-2-1-3-8-22/h4-6,9-10H,1-3,7-8H2,(H,21,23)
InChIKeyVEPBVSOBVLDORD-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
N-(3,5-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274620
N-(2,3-dimethylphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273787
5-(azepan-1-yl)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109289329
N-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273799
5-(azepan-1-yl)-N-(3-cyanophenyl)pyrazine-2-carboxamide
CID 109289409
5-(azepan-1-yl)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109289350
methyl 3-[(5-piperidin-1-ylpyrazine-2-carbonyl)amino]benzoate
CID 109274586
N-(2,6-dichlorophenyl)-2-pyrrolidin-1-ylpyrimidine-5-carboxamide
CID 109249509
5-(azepan-1-yl)-N-[4-(dimethylamino)phenyl]pyrazine-2-carboxamide
CID 109289373
N-(2,6-dimethylphenyl)-5-(4-phenylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109285561
N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273814

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide (CID 109274621) is N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide is O=C(Nc1c(Cl)cccc1Cl)c1cnc(N2CCCCC2)cn1.
What is the InChIKey of N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The InChIKey is VEPBVSOBVLDORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O/c17-11-5-4-6-12(18)15(11)21-16(23)13-9-20-14(10-19-13)22-7-2-1-3-8-22/h4-6,9-10H,1-3,7-8H2,(H,21,23).
What are the key properties of N-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
N-(2,6-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-(2,6-dichlorophenyl)-5-piperidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109274621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).