N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide

C14H19FN2O2 — CID 114839641

IUPACN-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide
SMILESCOc1cc(NC(=O)C2(C)CCCCN2)ccc1F
InChIInChI=1S/C14H19FN2O2/c1-14(7-3-4-8-16-14)13(18)17-10-5-6-11(15)12(9-10)19-2/h5-6,9,16H,3-4,7-8H2,1-2H3,(H,17,18)
InChIKeyDSXLYTVAUXGLIC-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.31
Rot. Bonds3

About N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide

N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide (PubChem CID 114839641) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide
PubChem CID114839641
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide
SMILESCOc1cc(NC(=O)C2(C)CCCCN2)ccc1F
InChIInChI=1S/C14H19FN2O2/c1-14(7-3-4-8-16-14)13(18)17-10-5-6-11(15)12(9-10)19-2/h5-6,9,16H,3-4,7-8H2,1-2H3,(H,17,18)
InChIKeyDSXLYTVAUXGLIC-UHFFFAOYSA-N
XLogP2.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyano-4-fluorophenyl)-2-methylpiperidine-2-carboxamide
CID 104596735
N-(4-fluoro-2-methoxyphenyl)-2-methylpiperidine-2-carboxamide
CID 104596685
1-(aminomethyl)-N-(4-fluoro-3-methoxyphenyl)cycloheptane-1-carboxamide
CID 114839160
N-(4-bromo-3-methylphenyl)-2-methylpiperidine-2-carboxamide
CID 113368545
4-amino-N-(4-fluoro-3-methoxyphenyl)oxane-4-carboxamide
CID 114839694
2-methyl-N-(2,3,4,5,6-pentafluorophenyl)piperidine-2-carboxamide
CID 104597136
N-(5-chloro-2-methylphenyl)-2-methylpiperidine-2-carboxamide
CID 113368554
N-(4-ethylsulfonylphenyl)-2-methylpiperidine-2-carboxamide
CID 104596237
N-(2-chloro-5-fluorophenyl)-2-methylpiperidine-2-carboxamide
CID 107528549
N-(3,4-difluorophenyl)-2-methyl-7-oxoazepane-2-carboxamide
CID 110196340
N-(2-chloro-4,6-difluorophenyl)-2-methylpiperidine-2-carboxamide
CID 104597189
N-(2-bromo-4-chlorophenyl)-2-methylpiperidine-2-carboxamide
CID 113430886

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide?
The IUPAC name of N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide (CID 114839641) is N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide is COc1cc(NC(=O)C2(C)CCCCN2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide?
The InChIKey is DSXLYTVAUXGLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-14(7-3-4-8-16-14)13(18)17-10-5-6-11(15)12(9-10)19-2/h5-6,9,16H,3-4,7-8H2,1-2H3,(H,17,18).
What are the key properties of N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide?
N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methoxyphenyl)-2-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114839641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).