N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide

C16H24FN3O — CID 63248996

IUPACN-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide
SMILESCNCC1CCN(CCC(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C16H24FN3O/c1-18-12-13-5-8-20(9-6-13)10-7-16(21)19-15-4-2-3-14(17)11-15/h2-4,11,13,18H,5-10,12H2,1H3,(H,19,21)
InChIKeyDNFYYOXFXOXLCP-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.09
Rot. Bonds6

About N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide

N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide (PubChem CID 63248996) has the molecular formula C16H24FN3O and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide
PubChem CID63248996
Molecular FormulaC16H24FN3O
Molecular Weight293.39 g/mol
Exact Mass293.19
IUPAC NameN-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide
SMILESCNCC1CCN(CCC(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C16H24FN3O/c1-18-12-13-5-8-20(9-6-13)10-7-16(21)19-15-4-2-3-14(17)11-15/h2-4,11,13,18H,5-10,12H2,1H3,(H,19,21)
InChIKeyDNFYYOXFXOXLCP-UHFFFAOYSA-N
XLogP2.09
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
CID 43037946
N-(3-fluorophenyl)-3-[4-(4-methylbenzoyl)piperidin-1-yl]propanamide
CID 55864910
3-[4-(2-ethoxyphenoxy)piperidin-1-yl]-N-(3-fluorophenyl)propanamide
CID 47532762
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-fluorophenyl)acetamide;hydrochloride
CID 119928163
3-[4-(dimethylamino)-4-methylpiperidin-1-yl]-N-(3-fluorophenyl)propanamide
CID 126830524
3-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-(3-fluorophenyl)propanamide;hydrochloride
CID 119927376
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 63248780
2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
tert-butyl N-[[1-[3-(3-fluoroanilino)-3-oxopropyl]piperidin-3-yl]methyl]carbamate
CID 60614622
N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide
CID 33363762
N-(3-fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide
CID 740647
2-(cyclobutylmethylamino)-N-(3-fluorophenyl)acetamide
CID 43298672

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide (CID 63248996) is N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide is CNCC1CCN(CCC(=O)Nc2cccc(F)c2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide?
The InChIKey is DNFYYOXFXOXLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O/c1-18-12-13-5-8-20(9-6-13)10-7-16(21)19-15-4-2-3-14(17)11-15/h2-4,11,13,18H,5-10,12H2,1H3,(H,19,21).
What are the key properties of N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide?
N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide has a molecular weight of 293.39 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-[4-(methylaminomethyl)piperidin-1-yl]propanamide is sourced from PubChem (CID 63248996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).