N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide

C10H19FN2O — CID 155183393

IUPACN-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide
SMILESCCC(=O)NCC1(F)CCN(C)CC1
InChIInChI=1S/C10H19FN2O/c1-3-9(14)12-8-10(11)4-6-13(2)7-5-10/h3-8H2,1-2H3,(H,12,14)
InChIKeyQRKXLISLGCEYNY-UHFFFAOYSA-N
MW202.27 g/mol
LogP0.95
Rot. Bonds3

About N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide

N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide (PubChem CID 155183393) has the molecular formula C10H19FN2O and a molecular weight of 202.27 g/mol. Its IUPAC name is N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide.

Molecular Properties

Compound NameN-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide
PubChem CID155183393
Molecular FormulaC10H19FN2O
Molecular Weight202.27 g/mol
Exact Mass202.15
IUPAC NameN-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide
SMILESCCC(=O)NCC1(F)CCN(C)CC1
InChIInChI=1S/C10H19FN2O/c1-3-9(14)12-8-10(11)4-6-13(2)7-5-10/h3-8H2,1-2H3,(H,12,14)
InChIKeyQRKXLISLGCEYNY-UHFFFAOYSA-N
XLogP0.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]carbamate
CID 140958930
N-[(3-hydroxy-1-methylazetidin-3-yl)methyl]propanamide;methane
CID 158406361
3-[(1,4-dimethylpiperidin-4-yl)methylamino]-3-oxopropanoic acid
CID 104889410
N-[(1,4-dimethylpiperidin-4-yl)methyl]-3-(ethylamino)propanamide
CID 107164032
(4-fluoro-1-methylpiperidin-4-yl)methanol
CID 24729611
N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-methylsulfonylacetamide
CID 136521862
2-cyano-N-[(1,4-dimethylpiperidin-4-yl)methyl]acetamide
CID 104920672
2-(2-aminoethoxy)-N-[(1,4-dimethylpiperidin-4-yl)methyl]acetamide
CID 107164001
6-[(1,4-dimethylpiperidin-4-yl)methylamino]-6-oxohexanoic acid
CID 107163135
N-[[1-(bromomethyl)cyclohexyl]methyl]propanamide
CID 103969670
ethane;N-[[1-(hydroxymethyl)cyclobutyl]methyl]propanamide
CID 171523205
N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-(prop-2-ynylamino)acetamide
CID 107163946

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide?
The IUPAC name of N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide (CID 155183393) is N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide.
What is the SMILES notation for N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide?
The canonical SMILES for N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide is CCC(=O)NCC1(F)CCN(C)CC1.
What is the InChIKey of N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide?
The InChIKey is QRKXLISLGCEYNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2O/c1-3-9(14)12-8-10(11)4-6-13(2)7-5-10/h3-8H2,1-2H3,(H,12,14).
What are the key properties of N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide?
N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide has a molecular weight of 202.27 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluoro-1-methylpiperidin-4-yl)methyl]propanamide is sourced from PubChem (CID 155183393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).