(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone

C14H19FN2O2 — CID 65432499

IUPAC(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)c2c(F)cccc2OC)C1
InChIInChI=1S/C14H19FN2O2/c1-16-10-5-4-8-17(9-10)14(18)13-11(15)6-3-7-12(13)19-2/h3,6-7,10,16H,4-5,8-9H2,1-2H3
InChIKeyBHOXSMZNRKUGSD-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.66
Rot. Bonds3

About (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone

(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone (PubChem CID 65432499) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone
PubChem CID65432499
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)c2c(F)cccc2OC)C1
InChIInChI=1S/C14H19FN2O2/c1-16-10-5-4-8-17(9-10)14(18)13-11(15)6-3-7-12(13)19-2/h3,6-7,10,16H,4-5,8-9H2,1-2H3
InChIKeyBHOXSMZNRKUGSD-UHFFFAOYSA-N
XLogP1.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluoro-6-iodophenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119494037
1-(2-fluoro-6-methoxybenzoyl)piperidine-3-carboxylic acid
CID 65432629
(5-fluoro-2-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119493446
[(3S)-3-aminopyrrolidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone;hydrochloride
CID 119934296
(3-aminopyrrolidin-1-yl)-(2-fluoro-6-methoxyphenyl)methanone;hydrochloride
CID 119482707
[3-(methylamino)piperidin-1-yl]-(2,3,4,5,6-pentafluorophenyl)methanone
CID 62536372
3,9-diazabicyclo[4.2.1]nonan-3-yl-(2-fluoro-6-methoxyphenyl)methanone
CID 81483168
(4-bromopiperidin-1-yl)-(2-fluoro-6-methoxyphenyl)methanone
CID 80662755
(4-fluorophenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62535610
1-(2-fluoro-6-methoxybenzoyl)piperidine-4-carboxylic acid
CID 65432243
(4-bromo-2,6-difluorophenyl)-[(3R)-3-(methylamino)piperidin-1-yl]methanone
CID 124517167
(3,5-dimethoxy-4-methylphenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119493630

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone (CID 65432499) is (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone is CNC1CCCN(C(=O)c2c(F)cccc2OC)C1.
What is the InChIKey of (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone?
The InChIKey is BHOXSMZNRKUGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-16-10-5-4-8-17(9-10)14(18)13-11(15)6-3-7-12(13)19-2/h3,6-7,10,16H,4-5,8-9H2,1-2H3.
What are the key properties of (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone?
(2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone has a molecular weight of 266.32 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-6-methoxyphenyl)-[3-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 65432499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).