4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide

C15H21FN2O — CID 63236434

IUPAC4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
SMILESCN1CCC(CN(C)C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C15H21FN2O/c1-17-9-7-12(8-10-17)11-18(2)15(19)13-3-5-14(16)6-4-13/h3-6,12H,7-11H2,1-2H3
InChIKeyYIPDKMTWRFGPFU-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.24
Rot. Bonds3

About 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide

4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide (PubChem CID 63236434) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
PubChem CID63236434
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
SMILESCN1CCC(CN(C)C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C15H21FN2O/c1-17-9-7-12(8-10-17)11-18(2)15(19)13-3-5-14(16)6-4-13/h3-6,12H,7-11H2,1-2H3
InChIKeyYIPDKMTWRFGPFU-UHFFFAOYSA-N
XLogP2.24
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-isocyano-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 123896887
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 63373062
4-(chloromethyl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 63275957
4-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 63274929
1-(4-fluorophenyl)-4-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]butan-1-one
CID 63273502
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-4-(phenylsulfamoyl)benzamide
CID 118720903
4-amino-3,5-dichloro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 82813179
N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-3-yl]methyl]-4-fluoro-N-methylbenzamide
CID 45179371
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-1H-indole-6-carboxamide
CID 63373207
6-[methyl-[(1-methylpiperidin-4-yl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 63235015
5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 63274999
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103765252

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide?
The IUPAC name of 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide (CID 63236434) is 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide.
What is the SMILES notation for 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide?
The canonical SMILES for 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide is CN1CCC(CN(C)C(=O)c2ccc(F)cc2)CC1.
What is the InChIKey of 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide?
The InChIKey is YIPDKMTWRFGPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-17-9-7-12(8-10-17)11-18(2)15(19)13-3-5-14(16)6-4-13/h3-6,12H,7-11H2,1-2H3.
What are the key properties of 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide?
4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide has a molecular weight of 264.34 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide is sourced from PubChem (CID 63236434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).