2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide

C14H20ClN3O — CID 63638436

IUPAC2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide
SMILESCCN(c1cccc(Cl)c1C(N)=O)C1CCCNC1
InChIInChI=1S/C14H20ClN3O/c1-2-18(10-5-4-8-17-9-10)12-7-3-6-11(15)13(12)14(16)19/h3,6-7,10,17H,2,4-5,8-9H2,1H3,(H2,16,19)
InChIKeyZOQSPSGUKPJPKE-UHFFFAOYSA-N
MW281.79 g/mol
LogP2.02
Rot. Bonds4

About 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide

2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide (PubChem CID 63638436) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide.

Molecular Properties

Compound Name2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide
PubChem CID63638436
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide
SMILESCCN(c1cccc(Cl)c1C(N)=O)C1CCCNC1
InChIInChI=1S/C14H20ClN3O/c1-2-18(10-5-4-8-17-9-10)12-7-3-6-11(15)13(12)14(16)19/h3,6-7,10,17H,2,4-5,8-9H2,1H3,(H2,16,19)
InChIKeyZOQSPSGUKPJPKE-UHFFFAOYSA-N
XLogP2.02
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-[ethyl(piperidin-3-yl)amino]benzamide
CID 114893995
3-chloro-4-[piperidin-3-yl(propyl)amino]benzamide
CID 63636499
2-chloro-N-ethyl-N-piperidin-3-ylbenzamide
CID 63638302
N-ethyl-N-[2-(trifluoromethyl)phenyl]piperidin-3-amine
CID 63636998
6-[ethyl(piperidin-3-yl)amino]pyridine-3-carboxamide
CID 63637691
2-chloro-6-fluoro-N-piperidin-3-yl-N-propylbenzamide
CID 63636405
2-bromo-4-[ethyl(piperidin-3-yl)amino]benzamide
CID 107280707
2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide
CID 55244733
N-[(2,6-dichlorophenyl)methyl]-N-ethylpiperidin-3-amine
CID 63643457
N-ethyl-N-(2-fluorophenyl)azepan-3-amine
CID 113229556
3-chloro-1-N-cyclopentyl-1-N-ethylbenzene-1,2-diamine
CID 104834130
2-[azetidin-3-yl(propyl)amino]-6-fluorobenzamide
CID 79523206

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide?
The IUPAC name of 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide (CID 63638436) is 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide.
What is the SMILES notation for 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide?
The canonical SMILES for 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide is CCN(c1cccc(Cl)c1C(N)=O)C1CCCNC1.
What is the InChIKey of 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide?
The InChIKey is ZOQSPSGUKPJPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-2-18(10-5-4-8-17-9-10)12-7-3-6-11(15)13(12)14(16)19/h3,6-7,10,17H,2,4-5,8-9H2,1H3,(H2,16,19).
What are the key properties of 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide?
2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide has a molecular weight of 281.79 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide is sourced from PubChem (CID 63638436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).