N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide

C16H23N3O2 — CID 4818617

IUPACN-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide
SMILESCC1CCCCN1CC(=O)NC(=O)NCc1ccccc1
InChIInChI=1S/C16H23N3O2/c1-13-7-5-6-10-19(13)12-15(20)18-16(21)17-11-14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H2,17,18,20,21)
InChIKeyOUULZDBZOMTEJV-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.89
Rot. Bonds4

About N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide

N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide (PubChem CID 4818617) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide
PubChem CID4818617
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide
SMILESCC1CCCCN1CC(=O)NC(=O)NCc1ccccc1
InChIInChI=1S/C16H23N3O2/c1-13-7-5-6-10-19(13)12-15(20)18-16(21)17-11-14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H2,17,18,20,21)
InChIKeyOUULZDBZOMTEJV-UHFFFAOYSA-N
XLogP1.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide (CID 4818617) is N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide is CC1CCCCN1CC(=O)NC(=O)NCc1ccccc1.
What is the InChIKey of N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide?
The InChIKey is OUULZDBZOMTEJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-13-7-5-6-10-19(13)12-15(20)18-16(21)17-11-14-8-3-2-4-9-14/h2-4,8-9,13H,5-7,10-12H2,1H3,(H2,17,18,20,21).
What are the key properties of N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide?
N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide has a molecular weight of 289.38 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylcarbamoyl)-2-(2-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 4818617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).