N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide

C18H21N5O2 — CID 16613410

IUPACN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide
SMILESO=C(CN1CCC(NC(=O)c2cnccn2)CC1)Nc1ccccc1
InChIInChI=1S/C18H21N5O2/c24-17(21-14-4-2-1-3-5-14)13-23-10-6-15(7-11-23)22-18(25)16-12-19-8-9-20-16/h1-5,8-9,12,15H,6-7,10-11,13H2,(H,21,24)(H,22,25)
InChIKeyDKCSQFKBBBKIJZ-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.31
Rot. Bonds5

About N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide

N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide (PubChem CID 16613410) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide
PubChem CID16613410
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC NameN-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide
SMILESO=C(CN1CCC(NC(=O)c2cnccn2)CC1)Nc1ccccc1
InChIInChI=1S/C18H21N5O2/c24-17(21-14-4-2-1-3-5-14)13-23-10-6-15(7-11-23)22-18(25)16-12-19-8-9-20-16/h1-5,8-9,12,15H,6-7,10-11,13H2,(H,21,24)(H,22,25)
InChIKeyDKCSQFKBBBKIJZ-UHFFFAOYSA-N
XLogP1.31
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]carbamoyl]pyridine-2-carboxylic acid
CID 119180037
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-1-methylpyrazole-4-carboxamide
CID 18146068
N-[1-(4-phenylbenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 108557355
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 16589812
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 3220730
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55791150
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-4-(dimethylamino)benzamide
CID 42014034
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclohexanecarboxamide
CID 3220728
N-[1-[2-(3-methylanilino)-2-oxoethyl]piperidin-4-yl]pyridine-3-carboxamide
CID 3727872
methyl 4-(pyrazine-2-carbonylamino)piperidine-1-carboxylate
CID 110821817
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-4-(2-methylsulfanylimidazol-1-yl)benzamide
CID 55775744

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide (CID 16613410) is N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide is O=C(CN1CCC(NC(=O)c2cnccn2)CC1)Nc1ccccc1.
What is the InChIKey of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide?
The InChIKey is DKCSQFKBBBKIJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c24-17(21-14-4-2-1-3-5-14)13-23-10-6-15(7-11-23)22-18(25)16-12-19-8-9-20-16/h1-5,8-9,12,15H,6-7,10-11,13H2,(H,21,24)(H,22,25).
What are the key properties of N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide?
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 16613410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).