2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide

C19H19ClN2O2 — CID 887708

IUPAC2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1Cl
InChIInChI=1S/C19H19ClN2O2/c20-17-7-3-2-6-16(17)18(23)21-15-10-8-14(9-11-15)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23)
InChIKeyZOORZLJWEZOBKO-UHFFFAOYSA-N
MW342.83 g/mol
LogP4.22
Rot. Bonds3

About 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide

2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide (PubChem CID 887708) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
PubChem CID887708
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1Cl
InChIInChI=1S/C19H19ClN2O2/c20-17-7-3-2-6-16(17)18(23)21-15-10-8-14(9-11-15)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23)
InChIKeyZOORZLJWEZOBKO-UHFFFAOYSA-N
XLogP4.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide (CID 887708) is 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide is O=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide?
The InChIKey is ZOORZLJWEZOBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c20-17-7-3-2-6-16(17)18(23)21-15-10-8-14(9-11-15)19(24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2,(H,21,23).
What are the key properties of 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide?
2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide has a molecular weight of 342.83 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 887708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).