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

C20H23N5O3 — CID 83281431

IUPAC3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESCCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccc2)CC1
InChIInChI=1S/C20H23N5O3/c1-2-16(26)25-12-8-15(9-13-25)23-20(28)17-18(22-11-10-21-17)24-19(27)14-6-4-3-5-7-14/h3-7,10-11,15H,2,8-9,12-13H2,1H3,(H,23,28)(H,22,24,27)
InChIKeyQHYOPRAPXUAZMW-UHFFFAOYSA-N
MW381.44 g/mol
LogP1.86
Rot. Bonds5

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

3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide (PubChem CID 83281431) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide
PubChem CID83281431
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC Name3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESCCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccc2)CC1
InChIInChI=1S/C20H23N5O3/c1-2-16(26)25-12-8-15(9-13-25)23-20(28)17-18(22-11-10-21-17)24-19(27)14-6-4-3-5-7-14/h3-7,10-11,15H,2,8-9,12-13H2,1H3,(H,23,28)(H,22,24,27)
InChIKeyQHYOPRAPXUAZMW-UHFFFAOYSA-N
XLogP1.86
TPSA104.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide
CID 90488210
3-[(4-methylbenzoyl)amino]-N-[1-(2-phenylacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853891
N-(1-benzoylpiperidin-4-yl)-3-[(4-fluorobenzoyl)amino]pyrazine-2-carboxamide
CID 42853839
3-[(3-methylbenzoyl)amino]-N-[1-(3-methylbutanoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 46049142
N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
CID 42866695
N-(1-benzylpiperidin-4-yl)-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866621
3-[(4-methoxybenzoyl)amino]-N-[1-(2-methoxybenzoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853875
N-[1-(cyclohexylcarbamoyl)piperidin-4-yl]-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866717
3-[(3-fluorobenzoyl)amino]-N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]pyrazine-2-carboxamide
CID 83284560
N-cyclopentyl-3-[(4-methylbenzoyl)amino]pyrazine-2-carboxamide
CID 53166495
3-phenyl-N-(1-propanoylpiperidin-4-yl)benzamide
CID 110819130
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-[(2-fluorobenzoyl)amino]pyrazine-2-carboxamide
CID 46049085

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide (CID 83281431) is 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide is CCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccc2)CC1.
What is the InChIKey of 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide?
The InChIKey is QHYOPRAPXUAZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-2-16(26)25-12-8-15(9-13-25)23-20(28)17-18(22-11-10-21-17)24-19(27)14-6-4-3-5-7-14/h3-7,10-11,15H,2,8-9,12-13H2,1H3,(H,23,28)(H,22,24,27).
What are the key properties of 3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide?
3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide has a molecular weight of 381.44 g/mol, XLogP of 1.86, 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-propanoylpiperidin-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 83281431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).