2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide

C16H23N3O — CID 63254765

IUPAC2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide
SMILESNC(=O)c1ccccc1N1CCCCC1C1CCCN1
InChIInChI=1S/C16H23N3O/c17-16(20)12-6-1-2-8-14(12)19-11-4-3-9-15(19)13-7-5-10-18-13/h1-2,6,8,13,15,18H,3-5,7,9-11H2,(H2,17,20)
InChIKeyLKMLTRDLHZBXHZ-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.90
Rot. Bonds3

About 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide

2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide (PubChem CID 63254765) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide.

Molecular Properties

Compound Name2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide
PubChem CID63254765
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide
SMILESNC(=O)c1ccccc1N1CCCCC1C1CCCN1
InChIInChI=1S/C16H23N3O/c17-16(20)12-6-1-2-8-14(12)19-11-4-3-9-15(19)13-7-5-10-18-13/h1-2,6,8,13,15,18H,3-5,7,9-11H2,(H2,17,20)
InChIKeyLKMLTRDLHZBXHZ-UHFFFAOYSA-N
XLogP1.90
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide?
The IUPAC name of 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide (CID 63254765) is 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide.
What is the SMILES notation for 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide?
The canonical SMILES for 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide is NC(=O)c1ccccc1N1CCCCC1C1CCCN1.
What is the InChIKey of 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide?
The InChIKey is LKMLTRDLHZBXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c17-16(20)12-6-1-2-8-14(12)19-11-4-3-9-15(19)13-7-5-10-18-13/h1-2,6,8,13,15,18H,3-5,7,9-11H2,(H2,17,20).
What are the key properties of 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide?
2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide has a molecular weight of 273.38 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyrrolidin-2-ylpiperidin-1-yl)benzamide is sourced from PubChem (CID 63254765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).