2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide

C14H17N3O3 — CID 82342701

IUPAC2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)CN1CCC(=O)CC1
InChIInChI=1S/C14H17N3O3/c15-14(20)11-3-1-2-4-12(11)16-13(19)9-17-7-5-10(18)6-8-17/h1-4H,5-9H2,(H2,15,20)(H,16,19)
InChIKeyWXTMPJRCLLXMKC-UHFFFAOYSA-N
MW275.31 g/mol
LogP0.39
Rot. Bonds4

About 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide

2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide (PubChem CID 82342701) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide
PubChem CID82342701
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)CN1CCC(=O)CC1
InChIInChI=1S/C14H17N3O3/c15-14(20)11-3-1-2-4-12(11)16-13(19)9-17-7-5-10(18)6-8-17/h1-4H,5-9H2,(H2,15,20)(H,16,19)
InChIKeyWXTMPJRCLLXMKC-UHFFFAOYSA-N
XLogP0.39
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylphenyl)-2-(4-oxopiperidin-1-yl)acetamide
CID 24693967
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2-[[2-[4-(hydroxymethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 60968756
2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]benzamide
CID 55511052
2-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]amino]benzamide
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2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]benzamide
CID 4692603
2-[[2-[4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl]acetyl]amino]benzamide
CID 18284875
2-[[2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetyl]amino]benzamide
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2-[[2-(2-oxo-1,3-thiazolidin-3-yl)acetyl]amino]benzamide
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2-[[2-[4-(4-fluorobenzoyl)piperazin-1-yl]acetyl]amino]benzamide
CID 36877900
2-[[2-(3-methylpiperidin-1-yl)acetyl]amino]benzamide
CID 22197772
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CID 1374696

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide?
The IUPAC name of 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide (CID 82342701) is 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide?
The canonical SMILES for 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide is NC(=O)c1ccccc1NC(=O)CN1CCC(=O)CC1.
What is the InChIKey of 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide?
The InChIKey is WXTMPJRCLLXMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c15-14(20)11-3-1-2-4-12(11)16-13(19)9-17-7-5-10(18)6-8-17/h1-4H,5-9H2,(H2,15,20)(H,16,19).
What are the key properties of 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide?
2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide has a molecular weight of 275.31 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-oxopiperidin-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 82342701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).