3-chloro-N-(2-piperidin-1-ylethyl)benzamide

C14H19ClN2O — CID 4581034

IUPAC3-chloro-N-(2-piperidin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCCCC1)c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O/c15-13-6-4-5-12(11-13)14(18)16-7-10-17-8-2-1-3-9-17/h4-6,11H,1-3,7-10H2,(H,16,18)
InChIKeyKADYKPZFCWZMDB-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.56
Rot. Bonds4

About 3-chloro-N-(2-piperidin-1-ylethyl)benzamide

3-chloro-N-(2-piperidin-1-ylethyl)benzamide (PubChem CID 4581034) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 3-chloro-N-(2-piperidin-1-ylethyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(2-piperidin-1-ylethyl)benzamide
PubChem CID4581034
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name3-chloro-N-(2-piperidin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCCCC1)c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O/c15-13-6-4-5-12(11-13)14(18)16-7-10-17-8-2-1-3-9-17/h4-6,11H,1-3,7-10H2,(H,16,18)
InChIKeyKADYKPZFCWZMDB-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
3-methyl-N-(2-piperidin-1-ylethyl)benzamide;hydrochloride
CID 126477808
2-(3-chlorophenyl)-1,3-dioxo-N-(2-piperidin-1-ylethyl)isoindole-5-carboxamide
CID 69277588
3-iodo-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 60682573
3-amino-N-(2-pyrrolidin-1-ylethyl)benzamide;dihydrochloride
CID 119834336
3-chloro-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]benzamide
CID 42266643
3-chloro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide
CID 46537539
3-chloro-N-[2-oxo-2-[2-(2-oxoazepan-1-yl)ethylamino]ethyl]benzamide
CID 55694248
3-chloro-N-[4-(4-ethylpiperazin-1-yl)butyl]benzamide
CID 110442007
N-[2-(azepan-1-ylsulfonyl)ethyl]-3-chlorobenzamide
CID 110346034
2-[4-[(3-chlorobenzoyl)amino]piperidin-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 42847963
3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The IUPAC name of 3-chloro-N-(2-piperidin-1-ylethyl)benzamide (CID 4581034) is 3-chloro-N-(2-piperidin-1-ylethyl)benzamide.
What is the SMILES notation for 3-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The canonical SMILES for 3-chloro-N-(2-piperidin-1-ylethyl)benzamide is O=C(NCCN1CCCCC1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2-piperidin-1-ylethyl)benzamide?
The InChIKey is KADYKPZFCWZMDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c15-13-6-4-5-12(11-13)14(18)16-7-10-17-8-2-1-3-9-17/h4-6,11H,1-3,7-10H2,(H,16,18).
What are the key properties of 3-chloro-N-(2-piperidin-1-ylethyl)benzamide?
3-chloro-N-(2-piperidin-1-ylethyl)benzamide has a molecular weight of 266.77 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-piperidin-1-ylethyl)benzamide is sourced from PubChem (CID 4581034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).