3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide

C15H21ClN2O — CID 106627859

IUPAC3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1cc(Cl)cc(C(=O)N(C)CC2CCCNC2)c1
InChIInChI=1S/C15H21ClN2O/c1-11-6-13(8-14(16)7-11)15(19)18(2)10-12-4-3-5-17-9-12/h6-8,12,17H,3-5,9-10H2,1-2H3
InChIKeyFVFWFTFPIWVUPM-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.72
Rot. Bonds3

About 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide

3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 106627859) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID106627859
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1cc(Cl)cc(C(=O)N(C)CC2CCCNC2)c1
InChIInChI=1S/C15H21ClN2O/c1-11-6-13(8-14(16)7-11)15(19)18(2)10-12-4-3-5-17-9-12/h6-8,12,17H,3-5,9-10H2,1-2H3
InChIKeyFVFWFTFPIWVUPM-UHFFFAOYSA-N
XLogP2.72
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-3-fluoro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107990969
4-bromo-3-chloro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627732
3,5-dichloro-N-cyclopropyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628660
2-fluoro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628063
N-methyl-N-(piperidin-3-ylmethyl)pyrimidine-5-carboxamide
CID 106627674
5-bromo-N-methyl-N-(piperidin-3-ylmethyl)thiophene-3-carboxamide
CID 114021534
2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627741
N,3-dimethyl-N-(piperidin-3-ylmethyl)-1,2-oxazole-5-carboxamide
CID 106627878
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627610
3-chloro-N-(2-chloroethyl)-N,5-dimethylbenzamide
CID 81324251
3,5-dichloro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607655
N-methyl-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 71642081

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide (CID 106627859) is 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide is Cc1cc(Cl)cc(C(=O)N(C)CC2CCCNC2)c1.
What is the InChIKey of 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is FVFWFTFPIWVUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-11-6-13(8-14(16)7-11)15(19)18(2)10-12-4-3-5-17-9-12/h6-8,12,17H,3-5,9-10H2,1-2H3.
What are the key properties of 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 280.80 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 106627859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).