N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride

C16H24ClN3O2 — CID 119557882

IUPACN-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride
SMILESCl.O=C(CNC(=O)c1ccccc1)NCCC1CCCNC1
InChIInChI=1S/C16H23N3O2.ClH/c20-15(18-10-8-13-5-4-9-17-11-13)12-19-16(21)14-6-2-1-3-7-14;/h1-3,6-7,13,17H,4-5,8-12H2,(H,18,20)(H,19,21);1H
InChIKeyWUUBKAMCMFCHAZ-UHFFFAOYSA-N
MW325.84 g/mol
LogP1.34
Rot. Bonds6

About N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride

N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride (PubChem CID 119557882) has the molecular formula C16H24ClN3O2 and a molecular weight of 325.84 g/mol. Its IUPAC name is N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride
PubChem CID119557882
Molecular FormulaC16H24ClN3O2
Molecular Weight325.84 g/mol
Exact Mass325.16
IUPAC NameN-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride
SMILESCl.O=C(CNC(=O)c1ccccc1)NCCC1CCCNC1
InChIInChI=1S/C16H23N3O2.ClH/c20-15(18-10-8-13-5-4-9-17-11-13)12-19-16(21)14-6-2-1-3-7-14;/h1-3,6-7,13,17H,4-5,8-12H2,(H,18,20)(H,19,21);1H
InChIKeyWUUBKAMCMFCHAZ-UHFFFAOYSA-N
XLogP1.34
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]-2-phenylacetamide
CID 119555564
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
4-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554925
3-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555518
4-chloro-N-[4-oxo-4-(2-piperidin-3-ylethylamino)butyl]benzamide;hydrochloride
CID 119557355
3-chloro-N-(2-piperidin-3-ylethyl)benzamide
CID 63628186
4-N-(2,2-dimethylpropyl)-1-N-(2-piperidin-3-ylethyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119558369
1-N-methyl-3-N-(2-piperidin-3-ylethyl)benzene-1,3-dicarboxamide
CID 119559534
4-methoxy-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119556793
4-tert-butyl-N-[3-oxo-3-(2-piperidin-3-ylethylamino)propyl]benzamide
CID 119556823
2-(4-methylphenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260712
2-(4-bromophenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557338

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride?
The IUPAC name of N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride (CID 119557882) is N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride.
What is the SMILES notation for N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride?
The canonical SMILES for N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride is Cl.O=C(CNC(=O)c1ccccc1)NCCC1CCCNC1.
What is the InChIKey of N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride?
The InChIKey is WUUBKAMCMFCHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2.ClH/c20-15(18-10-8-13-5-4-9-17-11-13)12-19-16(21)14-6-2-1-3-7-14;/h1-3,6-7,13,17H,4-5,8-12H2,(H,18,20)(H,19,21);1H.
What are the key properties of N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride?
N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride has a molecular weight of 325.84 g/mol, XLogP of 1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]benzamide;hydrochloride is sourced from PubChem (CID 119557882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).