2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide

C16H19FN2O2 — CID 43401439

IUPAC2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCC(NCCc1cccc(F)c1)C(=O)NCc1ccco1
InChIInChI=1S/C16H19FN2O2/c1-12(16(20)19-11-15-6-3-9-21-15)18-8-7-13-4-2-5-14(17)10-13/h2-6,9-10,12,18H,7-8,11H2,1H3,(H,19,20)
InChIKeyKNZYFCXRCQIJBV-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.26
Rot. Bonds7

About 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide

2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide (PubChem CID 43401439) has the molecular formula C16H19FN2O2 and a molecular weight of 290.34 g/mol. Its IUPAC name is 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
PubChem CID43401439
Molecular FormulaC16H19FN2O2
Molecular Weight290.34 g/mol
Exact Mass290.14
IUPAC Name2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
SMILESCC(NCCc1cccc(F)c1)C(=O)NCc1ccco1
InChIInChI=1S/C16H19FN2O2/c1-12(16(20)19-11-15-6-3-9-21-15)18-8-7-13-4-2-5-14(17)10-13/h2-6,9-10,12,18H,7-8,11H2,1H3,(H,19,20)
InChIKeyKNZYFCXRCQIJBV-UHFFFAOYSA-N
XLogP2.26
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-fluorophenyl)ethylamino]-N-propan-2-ylpropanamide
CID 43401436
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
N-(furan-2-ylmethyl)-2-[(3,4,5-trifluorophenyl)methylamino]propanamide
CID 119129013
N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
CID 43401425
2-[(3-bromophenyl)methylamino]-N-(furan-2-ylmethyl)propanamide
CID 61401140
2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide
CID 43088700
N-[2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]ethyl]cyclopropanecarboxamide
CID 115574214
1-(3-fluorophenyl)-N-(furan-2-ylmethyl)propan-2-amine
CID 115634120
ethyl 2-[2-(3-fluorophenyl)ethylamino]propanoate
CID 55134787
2-[(3-cyanophenyl)methylamino]-N-(furan-2-ylmethyl)propanamide
CID 60918229
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
CID 7437364

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide (CID 43401439) is 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide is CC(NCCc1cccc(F)c1)C(=O)NCc1ccco1.
What is the InChIKey of 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is KNZYFCXRCQIJBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O2/c1-12(16(20)19-11-15-6-3-9-21-15)18-8-7-13-4-2-5-14(17)10-13/h2-6,9-10,12,18H,7-8,11H2,1H3,(H,19,20).
What are the key properties of 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide?
2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 290.34 g/mol, XLogP of 2.26, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 43401439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).