2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide

C15H20Cl2N2O — CID 17249839

IUPAC2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide
SMILESCCCN1CCC(NC(=O)c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C15H20Cl2N2O/c1-2-8-19-9-6-11(7-10-19)18-15(20)14-12(16)4-3-5-13(14)17/h3-5,11H,2,6-10H2,1H3,(H,18,20)
InChIKeyYXCZZFRJVUTLNW-UHFFFAOYSA-N
MW315.24 g/mol
LogP3.60
Rot. Bonds4

About 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide

2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide (PubChem CID 17249839) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide
PubChem CID17249839
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide
SMILESCCCN1CCC(NC(=O)c2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C15H20Cl2N2O/c1-2-8-19-9-6-11(7-10-19)18-15(20)14-12(16)4-3-5-13(14)17/h3-5,11H,2,6-10H2,1H3,(H,18,20)
InChIKeyYXCZZFRJVUTLNW-UHFFFAOYSA-N
XLogP3.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-dichloro-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
CID 60693528
3-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 17249825
3-hydroxy-N-(1-propylpiperidin-4-yl)benzamide
CID 60664742
3-chloro-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 66484717
3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
CID 62178316
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951
5-bromo-N-(1-propylpiperidin-4-yl)thiophene-2-carboxamide
CID 17249869
2,6-dichloro-N-(1-propan-2-ylazepan-4-yl)benzamide
CID 155556170
2-ethoxy-N-(1-propylpiperidin-4-yl)naphthalene-1-carboxamide
CID 17173537
2-amino-3-chloro-N-(1-ethylpiperidin-4-yl)benzamide
CID 115540437
4-chloro-3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-4-yl)benzamide
CID 9264502
N-(4-aminocyclohexyl)-2,6-dichlorobenzamide
CID 62313124

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide?
The IUPAC name of 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide (CID 17249839) is 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide is CCCN1CCC(NC(=O)c2c(Cl)cccc2Cl)CC1.
What is the InChIKey of 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide?
The InChIKey is YXCZZFRJVUTLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-2-8-19-9-6-11(7-10-19)18-15(20)14-12(16)4-3-5-13(14)17/h3-5,11H,2,6-10H2,1H3,(H,18,20).
What are the key properties of 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide?
2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide has a molecular weight of 315.24 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide is sourced from PubChem (CID 17249839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).