3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide

C19H23FN2O2 — CID 95120065

IUPAC3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide
SMILESO=C(CCN1CCCC[C@@H]1c1ccc(F)cc1)NCc1ccco1
InChIInChI=1S/C19H23FN2O2/c20-16-8-6-15(7-9-16)18-5-1-2-11-22(18)12-10-19(23)21-14-17-4-3-13-24-17/h3-4,6-9,13,18H,1-2,5,10-12,14H2,(H,21,23)/t18-/m1/s1
InChIKeyKTGQYVAGBXAITC-GOSISDBHSA-N
MW330.40 g/mol
LogP3.65
Rot. Bonds6

About 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide

3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide (PubChem CID 95120065) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide
PubChem CID95120065
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC Name3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide
SMILESO=C(CCN1CCCC[C@@H]1c1ccc(F)cc1)NCc1ccco1
InChIInChI=1S/C19H23FN2O2/c20-16-8-6-15(7-9-16)18-5-1-2-11-22(18)12-10-19(23)21-14-17-4-3-13-24-17/h3-4,6-9,13,18H,1-2,5,10-12,14H2,(H,21,23)/t18-/m1/s1
InChIKeyKTGQYVAGBXAITC-GOSISDBHSA-N
XLogP3.65
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepan-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 109018473
N-(furan-2-ylmethyl)-3-piperidin-1-ylpropanamide
CID 110688280
3-[(2S)-2-(4-fluorophenyl)piperidin-1-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 95894518
2-[2-(4-fluorophenyl)-4-hydroxypyrrolidin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 128972858
2-[(2R)-2-ethylpiperidin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 94775933
2-[(1R,4aS,8aS)-1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-(furan-2-ylmethyl)acetamide
CID 11909904
5-[(2R)-1-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidin-2-yl]-N,1-dimethylpyrrole-2-carboxamide
CID 129334180
2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 51094831
2-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 42814442
3-[2-(4-fluorophenyl)azetidin-1-yl]-N-propan-2-ylpropanamide
CID 91843072
N-(furan-2-ylmethylcarbamoyl)-2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide
CID 47006382
(3S)-1-(4-fluorophenyl)sulfonyl-N-[3-(furan-2-ylmethylamino)-3-oxopropyl]piperidine-3-carboxamide
CID 41008117

Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide (CID 95120065) is 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide is O=C(CCN1CCCC[C@@H]1c1ccc(F)cc1)NCc1ccco1.
What is the InChIKey of 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is KTGQYVAGBXAITC-GOSISDBHSA-N. The full InChI is InChI=1S/C19H23FN2O2/c20-16-8-6-15(7-9-16)18-5-1-2-11-22(18)12-10-19(23)21-14-17-4-3-13-24-17/h3-4,6-9,13,18H,1-2,5,10-12,14H2,(H,21,23)/t18-/m1/s1.
What are the key properties of 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide?
3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 330.40 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 95120065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).