2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide

C16H25N3O — CID 110463573

IUPAC2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(N(C)C(=O)c2ccccc2N(C)C)CC1
InChIInChI=1S/C16H25N3O/c1-17(2)15-8-6-5-7-14(15)16(20)19(4)13-9-11-18(3)12-10-13/h5-8,13H,9-12H2,1-4H3
InChIKeyQFUCJVOMYOIOPS-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.92
Rot. Bonds3

About 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide

2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide (PubChem CID 110463573) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
PubChem CID110463573
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(N(C)C(=O)c2ccccc2N(C)C)CC1
InChIInChI=1S/C16H25N3O/c1-17(2)15-8-6-5-7-14(15)16(20)19(4)13-9-11-18(3)12-10-13/h5-8,13H,9-12H2,1-4H3
InChIKeyQFUCJVOMYOIOPS-UHFFFAOYSA-N
XLogP1.92
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide?
The IUPAC name of 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide (CID 110463573) is 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide is CN1CCC(N(C)C(=O)c2ccccc2N(C)C)CC1.
What is the InChIKey of 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide?
The InChIKey is QFUCJVOMYOIOPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-17(2)15-8-6-5-7-14(15)16(20)19(4)13-9-11-18(3)12-10-13/h5-8,13H,9-12H2,1-4H3.
What are the key properties of 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide?
2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide has a molecular weight of 275.40 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 110463573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).