5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide

C15H21FN2O — CID 106627610

IUPAC5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1ccc(F)cc1C(=O)N(C)CC1CCCNC1
InChIInChI=1S/C15H21FN2O/c1-11-5-6-13(16)8-14(11)15(19)18(2)10-12-4-3-7-17-9-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3
InChIKeyOSAHGULHVUNGAI-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.21
Rot. Bonds3

About 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide

5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 106627610) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID106627610
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1ccc(F)cc1C(=O)N(C)CC1CCCNC1
InChIInChI=1S/C15H21FN2O/c1-11-5-6-13(16)8-14(11)15(19)18(2)10-12-4-3-7-17-9-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3
InChIKeyOSAHGULHVUNGAI-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N,3-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627734
2-fluoro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628063
5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
2-bromo-N,3-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 107983274
N-(cyclobutylmethyl)-4-fluoro-N,2-dimethylbenzamide
CID 115745878
2-bromo-3-fluoro-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627953
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63050163
2,4-dibromo-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107940298
2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627741
4-fluoro-2-hydroxy-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 107016147
N-(cyclobutylmethyl)-5-fluoro-2-hydroxy-N-methylbenzamide
CID 79882440

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide (CID 106627610) is 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide is Cc1ccc(F)cc1C(=O)N(C)CC1CCCNC1.
What is the InChIKey of 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is OSAHGULHVUNGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-11-5-6-13(16)8-14(11)15(19)18(2)10-12-4-3-7-17-9-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3.
What are the key properties of 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide?
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 264.34 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 106627610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).