2-chloro-N-ethyl-N-piperidin-3-ylbenzamide

C14H19ClN2O — CID 63638302

IUPAC2-chloro-N-ethyl-N-piperidin-3-ylbenzamide
SMILESCCN(C(=O)c1ccccc1Cl)C1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-2-17(11-6-5-9-16-10-11)14(18)12-7-3-4-8-13(12)15/h3-4,7-8,11,16H,2,5-6,9-10H2,1H3
InChIKeyWMEXLAMFJKWNHR-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.55
Rot. Bonds3

About 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide

2-chloro-N-ethyl-N-piperidin-3-ylbenzamide (PubChem CID 63638302) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-piperidin-3-ylbenzamide
PubChem CID63638302
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name2-chloro-N-ethyl-N-piperidin-3-ylbenzamide
SMILESCCN(C(=O)c1ccccc1Cl)C1CCCNC1
InChIInChI=1S/C14H19ClN2O/c1-2-17(11-6-5-9-16-10-11)14(18)12-7-3-4-8-13(12)15/h3-4,7-8,11,16H,2,5-6,9-10H2,1H3
InChIKeyWMEXLAMFJKWNHR-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-2-chloro-N-ethylbenzamide
CID 66182738
N-ethyl-2-oxo-N-piperidin-3-yl-1H-pyridine-3-carboxamide
CID 63636915
5-chloro-N-ethyl-2-fluoro-N-piperidin-3-ylbenzamide
CID 63637963
3-chloro-N-ethyl-N-piperidin-3-ylthiophene-2-carboxamide
CID 80641610
2-bromo-4-chloro-N-ethyl-N-piperidin-3-ylbenzamide
CID 107990350
N-ethyl-2-hydroxy-3-methoxy-N-piperidin-3-ylbenzamide
CID 60807403
2,4-dibromo-N-ethyl-N-piperidin-3-ylbenzamide
CID 107939910
2-chloro-4-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 106862150
N-ethyl-2-methylsulfanyl-N-pyrrolidin-3-ylbenzamide
CID 79217551
2-ethoxy-N-ethyl-N-pyrrolidin-3-ylbenzamide
CID 55026177
4-bromo-2-chloro-N-piperidin-3-yl-N-propylbenzamide
CID 63637268
N-(azepan-4-yl)-2-chloro-N-methylbenzamide
CID 104974708

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide?
The IUPAC name of 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide (CID 63638302) is 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide?
The canonical SMILES for 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide is CCN(C(=O)c1ccccc1Cl)C1CCCNC1.
What is the InChIKey of 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide?
The InChIKey is WMEXLAMFJKWNHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-2-17(11-6-5-9-16-10-11)14(18)12-7-3-4-8-13(12)15/h3-4,7-8,11,16H,2,5-6,9-10H2,1H3.
What are the key properties of 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide?
2-chloro-N-ethyl-N-piperidin-3-ylbenzamide has a molecular weight of 266.77 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-piperidin-3-ylbenzamide is sourced from PubChem (CID 63638302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).