N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide

C13H16F2N2O2 — CID 119673285

IUPACN-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)Nc2ccc(F)cc2F)CCNCC1
InChIInChI=1S/C13H16F2N2O2/c1-19-13(4-6-16-7-5-13)12(18)17-11-3-2-9(14)8-10(11)15/h2-3,8,16H,4-7H2,1H3,(H,17,18)
InChIKeyWRJGDOUJJNONRB-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.67
Rot. Bonds3

About N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide

N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide (PubChem CID 119673285) has the molecular formula C13H16F2N2O2 and a molecular weight of 270.28 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide
PubChem CID119673285
Molecular FormulaC13H16F2N2O2
Molecular Weight270.28 g/mol
Exact Mass270.12
IUPAC NameN-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)Nc2ccc(F)cc2F)CCNCC1
InChIInChI=1S/C13H16F2N2O2/c1-19-13(4-6-16-7-5-13)12(18)17-11-3-2-9(14)8-10(11)15/h2-3,8,16H,4-7H2,1H3,(H,17,18)
InChIKeyWRJGDOUJJNONRB-UHFFFAOYSA-N
XLogP1.67
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-difluoro-4-methoxyphenyl)-4-methoxypiperidine-4-carboxamide
CID 119812880
N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119705583
1-(2,4-difluorophenyl)-3-(4-methylpiperidin-4-yl)urea
CID 114696666
4-methoxy-N-(4-methoxy-2-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119709494
N-(4-fluoro-3-methylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119707232
(2,5-difluorophenyl)-(4-methoxypiperidin-4-yl)methanone
CID 114284487
N-(4-chloro-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119708344
N-(3-bromo-4-fluorophenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119708380
N-(3-fluoro-4-methoxyphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119705693
N-(4-chlorophenyl)-4-methoxypiperidine-4-carboxamide
CID 119671235
N-(4,5-dimethoxy-2-methylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119679109
N-[1-(2-chloro-4-fluorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119795506

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide (CID 119673285) is N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide is COC1(C(=O)Nc2ccc(F)cc2F)CCNCC1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide?
The InChIKey is WRJGDOUJJNONRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O2/c1-19-13(4-6-16-7-5-13)12(18)17-11-3-2-9(14)8-10(11)15/h2-3,8,16H,4-7H2,1H3,(H,17,18).
What are the key properties of N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide?
N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide has a molecular weight of 270.28 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-methoxypiperidine-4-carboxamide is sourced from PubChem (CID 119673285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).