N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide

C15H22FN3O3S — CID 126797872

IUPACN-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide
SMILESCN(C(=O)N1CCC(CNS(C)(=O)=O)CC1)c1ccc(F)cc1
InChIInChI=1S/C15H22FN3O3S/c1-18(14-5-3-13(16)4-6-14)15(20)19-9-7-12(8-10-19)11-17-23(2,21)22/h3-6,12,17H,7-11H2,1-2H3
InChIKeyZFGQZVKLGGLCBJ-UHFFFAOYSA-N
MW343.42 g/mol
LogP1.64
Rot. Bonds4

About N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide

N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide (PubChem CID 126797872) has the molecular formula C15H22FN3O3S and a molecular weight of 343.42 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide
PubChem CID126797872
Molecular FormulaC15H22FN3O3S
Molecular Weight343.42 g/mol
Exact Mass343.14
IUPAC NameN-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide
SMILESCN(C(=O)N1CCC(CNS(C)(=O)=O)CC1)c1ccc(F)cc1
InChIInChI=1S/C15H22FN3O3S/c1-18(14-5-3-13(16)4-6-14)15(20)19-9-7-12(8-10-19)11-17-23(2,21)22/h3-6,12,17H,7-11H2,1-2H3
InChIKeyZFGQZVKLGGLCBJ-UHFFFAOYSA-N
XLogP1.64
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 4-[[(4-fluorophenyl)sulfonylamino]methyl]piperidine-1-carboxylate
CID 18374698
4-[[(3-fluoro-4-methoxyphenyl)sulfonylamino]methyl]-N,N-dimethylpiperidine-1-carboxamide
CID 119103274
(3R)-1-[(4-fluorophenyl)-methylcarbamoyl]piperidine-3-carboxylic acid
CID 81121086
(3R,4R)-N-(4-fluorophenyl)-3-(hydroxymethyl)-N-methyl-4-phenylpiperidine-1-carboxamide
CID 126806042
4-fluoro-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 90521856
N-[[(3R)-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]pyrrolidin-3-yl]methyl]methanesulfonamide
CID 95188008
(2S)-1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]-2-methylsulfonylpropan-1-one
CID 95301170
N-[2-[4-(ethylaminomethyl)piperidine-1-carbonyl]-4-fluorophenyl]methanesulfonamide;hydrochloride
CID 119644374
N-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)methanesulfonamide
CID 1143321
4-(4-fluorophenyl)-N-methyl-N-[4-[[(3R)-3-methylpiperidin-1-yl]methyl]phenyl]piperidine-1-carboxamide
CID 58509859
N,3-bis(4-fluorophenyl)-3-(methanesulfonamido)-N-methylpropanamide
CID 133255111
3-[(2-bromophenyl)methyl]-N-(4-fluorophenyl)-N-methylazetidine-1-carboxamide
CID 166359337

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide (CID 126797872) is N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide is CN(C(=O)N1CCC(CNS(C)(=O)=O)CC1)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide?
The InChIKey is ZFGQZVKLGGLCBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O3S/c1-18(14-5-3-13(16)4-6-14)15(20)19-9-7-12(8-10-19)11-17-23(2,21)22/h3-6,12,17H,7-11H2,1-2H3.
What are the key properties of N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide?
N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide has a molecular weight of 343.42 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-(methanesulfonamidomethyl)-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 126797872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).