3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide

C15H21ClN2O — CID 81322966

IUPAC3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide
SMILESCc1cc(Cl)cc(C(=O)NC(C)C2CCCNC2)c1
InChIInChI=1S/C15H21ClN2O/c1-10-6-13(8-14(16)7-10)15(19)18-11(2)12-4-3-5-17-9-12/h6-8,11-12,17H,3-5,9H2,1-2H3,(H,18,19)
InChIKeyBLFZTLHIXUTNPJ-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.77
Rot. Bonds3

About 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide

3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide (PubChem CID 81322966) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide.

Molecular Properties

Compound Name3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide
PubChem CID81322966
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide
SMILESCc1cc(Cl)cc(C(=O)NC(C)C2CCCNC2)c1
InChIInChI=1S/C15H21ClN2O/c1-10-6-13(8-14(16)7-10)15(19)18-11(2)12-4-3-5-17-9-12/h6-8,11-12,17H,3-5,9H2,1-2H3,(H,18,19)
InChIKeyBLFZTLHIXUTNPJ-UHFFFAOYSA-N
XLogP2.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523133
3-chloro-5-nitro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119473927
N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
CID 62032705
5-chloro-2-iodo-N-(1-piperidin-3-ylethyl)benzamide
CID 103806067
2-chloro-N-(1-piperidin-3-ylethyl)benzamide
CID 62034679
1-methyl-2-oxo-N-(1-piperidin-3-ylethyl)pyridine-4-carboxamide
CID 103793645
5-bromo-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide
CID 113265499
3-fluoro-N-(1-piperidin-3-ylethyl)benzamide
CID 43523136
N-(1-piperidin-3-ylethyl)pyridazine-4-carboxamide
CID 104671340
N-(1-piperidin-3-ylethyl)-4-(trifluoromethyl)benzamide;hydrochloride
CID 119473934
2,3-dichloro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119473892
N-(1-piperidin-3-ylethyl)-1,3-benzodioxole-5-carboxamide;hydrochloride
CID 119474135

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide?
The IUPAC name of 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide (CID 81322966) is 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide.
What is the SMILES notation for 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide?
The canonical SMILES for 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide is Cc1cc(Cl)cc(C(=O)NC(C)C2CCCNC2)c1.
What is the InChIKey of 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide?
The InChIKey is BLFZTLHIXUTNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-10-6-13(8-14(16)7-10)15(19)18-11(2)12-4-3-5-17-9-12/h6-8,11-12,17H,3-5,9H2,1-2H3,(H,18,19).
What are the key properties of 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide?
3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide has a molecular weight of 280.80 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-methyl-N-(1-piperidin-3-ylethyl)benzamide is sourced from PubChem (CID 81322966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).