3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide

C17H25ClN2O — CID 745369

IUPAC3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
SMILESCc1ccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1Cl
InChIInChI=1S/C17H25ClN2O/c1-11-6-7-12(8-14(11)18)15(21)19-13-9-16(2,3)20-17(4,5)10-13/h6-8,13,20H,9-10H2,1-5H3,(H,19,21)
InChIKeyHJWSXRVLIXWFPV-UHFFFAOYSA-N
MW308.85 g/mol
LogP3.69
Rot. Bonds2

About 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide

3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide (PubChem CID 745369) has the molecular formula C17H25ClN2O and a molecular weight of 308.85 g/mol. Its IUPAC name is 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
PubChem CID745369
Molecular FormulaC17H25ClN2O
Molecular Weight308.85 g/mol
Exact Mass308.17
IUPAC Name3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
SMILESCc1ccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1Cl
InChIInChI=1S/C17H25ClN2O/c1-11-6-7-12(8-14(11)18)15(21)19-13-9-16(2,3)20-17(4,5)10-13/h6-8,13,20H,9-10H2,1-5H3,(H,19,21)
InChIKeyHJWSXRVLIXWFPV-UHFFFAOYSA-N
XLogP3.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.85
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide?
The IUPAC name of 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide (CID 745369) is 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide.
What is the SMILES notation for 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide?
The canonical SMILES for 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide is Cc1ccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1Cl.
What is the InChIKey of 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide?
The InChIKey is HJWSXRVLIXWFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2O/c1-11-6-7-12(8-14(11)18)15(21)19-13-9-16(2,3)20-17(4,5)10-13/h6-8,13,20H,9-10H2,1-5H3,(H,19,21).
What are the key properties of 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide?
3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide has a molecular weight of 308.85 g/mol, XLogP of 3.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide is sourced from PubChem (CID 745369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).