N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide

C15H21FN2O — CID 146322467

IUPACN-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide
SMILESCCN1CCC(C)(NC(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C15H21FN2O/c1-3-18-9-7-15(2,8-10-18)17-14(19)12-5-4-6-13(16)11-12/h4-6,11H,3,7-10H2,1-2H3,(H,17,19)
InChIKeyNAUDWHWGFJFOCJ-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.43
Rot. Bonds3

About N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide

N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide (PubChem CID 146322467) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide.

Molecular Properties

Compound NameN-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide
PubChem CID146322467
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide
SMILESCCN1CCC(C)(NC(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C15H21FN2O/c1-3-18-9-7-15(2,8-10-18)17-14(19)12-5-4-6-13(16)11-12/h4-6,11H,3,7-10H2,1-2H3,(H,17,19)
InChIKeyNAUDWHWGFJFOCJ-UHFFFAOYSA-N
XLogP2.43
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 ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethyl-3-methylpyrrolidin-3-yl)-2,6-difluorobenzamide
CID 142327023
N-[2-(4-ethylpiperazin-1-yl)sulfonylethyl]-3-fluorobenzamide
CID 42590095
N-[2-[[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78900100
3-fluoro-N-[2-[4-(3-fluorophenyl)-4-hydroxypiperidin-1-yl]ethyl]benzamide
CID 46965021
3-fluoro-N-[3-[(3-fluorobenzoyl)amino]-2,2-dimethylpropyl]benzamide
CID 2168496
3-fluoro-N-(3-hydroxy-2-methylpropyl)benzamide
CID 65031989
N-(2-ethyl-2-hydroxybutyl)-3-fluorobenzamide
CID 65111998
(3R)-8-ethyl-4-(3-fluorobenzoyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 95658196
1-[(3-fluorobenzoyl)amino]-3,3-dimethylcyclopentane-1-carboxylic acid
CID 166317351
3-(hydroxymethyl)-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)benzamide
CID 134505589
N-(1,4-dimethylpiperidin-4-yl)-3,4-difluorobenzamide
CID 134435231
N-[1-(aminomethyl)cyclopentyl]-3-fluorobenzamide
CID 16740505

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide?
The IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide (CID 146322467) is N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide.
What is the SMILES notation for N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide?
The canonical SMILES for N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide is CCN1CCC(C)(NC(=O)c2cccc(F)c2)CC1.
What is the InChIKey of N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide?
The InChIKey is NAUDWHWGFJFOCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-3-18-9-7-15(2,8-10-18)17-14(19)12-5-4-6-13(16)11-12/h4-6,11H,3,7-10H2,1-2H3,(H,17,19).
What are the key properties of N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide?
N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide has a molecular weight of 264.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-4-methylpiperidin-4-yl)-3-fluorobenzamide is sourced from PubChem (CID 146322467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).