3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide

C24H23N5O3 — CID 90488210

IUPAC3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1nccnc1C(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H23N5O3/c30-22(17-7-3-1-4-8-17)28-21-20(25-13-14-26-21)23(31)27-19-11-15-29(16-12-19)24(32)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H,27,31)(H,26,28,30)
InChIKeyWKRJRJVUAGORFI-UHFFFAOYSA-N
MW429.48 g/mol
LogP2.76
Rot. Bonds5

About 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide

3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide (PubChem CID 90488210) has the molecular formula C24H23N5O3 and a molecular weight of 429.48 g/mol. Its IUPAC name is 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide
PubChem CID90488210
Molecular FormulaC24H23N5O3
Molecular Weight429.48 g/mol
Exact Mass429.18
IUPAC Name3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1nccnc1C(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H23N5O3/c30-22(17-7-3-1-4-8-17)28-21-20(25-13-14-26-21)23(31)27-19-11-15-29(16-12-19)24(32)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H,27,31)(H,26,28,30)
InChIKeyWKRJRJVUAGORFI-UHFFFAOYSA-N
XLogP2.76
TPSA104.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-benzoylpiperidin-4-yl)-3-[(4-fluorobenzoyl)amino]pyrazine-2-carboxamide
CID 42853839
3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide
CID 83281431
3-[(2-fluorobenzoyl)amino]-N-[1-(4-methylbenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 46049084
N-[1-(3-fluorobenzoyl)piperidin-4-yl]-3-(furan-3-carbonylamino)pyrazine-2-carboxamide
CID 42866684
3-(furan-3-carbonylamino)-N-[1-(3-methylbenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42866687
3-[(4-methylbenzoyl)amino]-N-[1-(2-phenylacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853891
3-[(4-methoxybenzoyl)amino]-N-[1-(2-methoxybenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853875
N-[3-(azepane-1-carbonyl)pyrazin-2-yl]benzamide
CID 53166582
3-(cyclopentanecarbonylamino)-N-[1-(4-methylbenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853928
3-(3,3-dimethylbutanoylamino)-N-[1-(4-fluorobenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 91634641
N-(1-benzoylpiperidin-4-yl)-4-phenylbenzamide
CID 108549483
N-[1-(cyclohexylcarbamoyl)piperidin-4-yl]-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866717

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide (CID 90488210) is 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide is O=C(Nc1nccnc1C(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide?
The InChIKey is WKRJRJVUAGORFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O3/c30-22(17-7-3-1-4-8-17)28-21-20(25-13-14-26-21)23(31)27-19-11-15-29(16-12-19)24(32)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H,27,31)(H,26,28,30).
What are the key properties of 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide?
3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide has a molecular weight of 429.48 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 90488210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).