3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide

C15H20F2N2O — CID 119443603

IUPAC3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide
SMILESCN(C(=O)CCc1cc(F)ccc1F)C1CCNCC1
InChIInChI=1S/C15H20F2N2O/c1-19(13-6-8-18-9-7-13)15(20)5-2-11-10-12(16)3-4-14(11)17/h3-4,10,13,18H,2,5-9H2,1H3
InChIKeyJGOQTXCKHCNELH-UHFFFAOYSA-N
MW282.33 g/mol
LogP2.11
Rot. Bonds4

About 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide

3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide (PubChem CID 119443603) has the molecular formula C15H20F2N2O and a molecular weight of 282.33 g/mol. Its IUPAC name is 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound Name3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide
PubChem CID119443603
Molecular FormulaC15H20F2N2O
Molecular Weight282.33 g/mol
Exact Mass282.15
IUPAC Name3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide
SMILESCN(C(=O)CCc1cc(F)ccc1F)C1CCNCC1
InChIInChI=1S/C15H20F2N2O/c1-19(13-6-8-18-9-7-13)15(20)5-2-11-10-12(16)3-4-14(11)17/h3-4,10,13,18H,2,5-9H2,1H3
InChIKeyJGOQTXCKHCNELH-UHFFFAOYSA-N
XLogP2.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,5-difluorophenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532213
3-(2,3-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119441407
2-[3-(2,5-difluorophenyl)propanoyl-methylamino]acetic acid
CID 119171811
3-(4-chlorothiophen-2-yl)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119443256
2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide
CID 43602048
3-[(4-fluorophenyl)sulfonylamino]-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119441195
4-(3,4-difluorophenyl)-N-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119552359
1-[2-(2,5-difluorophenyl)ethyl]-3-methyl-1-(2-phenylbut-3-en-2-yl)-3-piperidin-4-ylurea;methylidenephosphane
CID 142888437
2,4-difluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443342
1-cyclopropyl-3-(2,5-difluorophenyl)propan-1-one
CID 63351882
N-[(1R,5R)-8-azabicyclo[3.2.1]octan-3-yl]-2-(2,5-difluorophenyl)-N-methylacetamide
CID 99850402
N-(azepan-4-yl)-N-methyl-3-phenylpropanamide
CID 104974503

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide?
The IUPAC name of 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide (CID 119443603) is 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide.
What is the SMILES notation for 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide?
The canonical SMILES for 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide is CN(C(=O)CCc1cc(F)ccc1F)C1CCNCC1.
What is the InChIKey of 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide?
The InChIKey is JGOQTXCKHCNELH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O/c1-19(13-6-8-18-9-7-13)15(20)5-2-11-10-12(16)3-4-14(11)17/h3-4,10,13,18H,2,5-9H2,1H3.
What are the key properties of 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide?
3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide has a molecular weight of 282.33 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 119443603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).