N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide

C15H23FN2O — CID 43420356

IUPACN,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide
SMILESCCN(CC)C(=O)C(C)NCCc1cccc(F)c1
InChIInChI=1S/C15H23FN2O/c1-4-18(5-2)15(19)12(3)17-10-9-13-7-6-8-14(16)11-13/h6-8,11-12,17H,4-5,9-10H2,1-3H3
InChIKeyWNPJBOHBAJNWKD-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.21
Rot. Bonds7

About N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide

N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide (PubChem CID 43420356) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide
PubChem CID43420356
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC NameN,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide
SMILESCCN(CC)C(=O)C(C)NCCc1cccc(F)c1
InChIInChI=1S/C15H23FN2O/c1-4-18(5-2)15(19)12(3)17-10-9-13-7-6-8-14(16)11-13/h6-8,11-12,17H,4-5,9-10H2,1-3H3
InChIKeyWNPJBOHBAJNWKD-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[2-(3-fluorophenyl)ethylamino]propanoate
CID 55134787
2-[2-(3-fluorophenyl)ethylamino]-N-propan-2-ylpropanamide
CID 43401436
N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
CID 43401425
(2S)-N-[2-(3-fluorophenyl)ethyl]butan-2-amine
CID 93246045
N-[2-(3-fluorophenyl)ethyl]butan-2-amine
CID 43565886
(2R)-2-amino-N-ethyl-N-[(3-fluorophenyl)methyl]propanamide
CID 78973383
2-[2-(3-fluorophenyl)ethylamino]-N'-hydroxypropanimidamide
CID 77030267
N-ethyl-N-[(3-fluorophenyl)methyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119690197
N,N-diethyl-2-[(4-fluorophenyl)methylamino]propanamide
CID 43112620
2-(benzylamino)-N,N-diethylpropanamide
CID 43112479
2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 43401439
2-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide
CID 9317159

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The IUPAC name of N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide (CID 43420356) is N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide.
What is the SMILES notation for N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The canonical SMILES for N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide is CCN(CC)C(=O)C(C)NCCc1cccc(F)c1.
What is the InChIKey of N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The InChIKey is WNPJBOHBAJNWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-4-18(5-2)15(19)12(3)17-10-9-13-7-6-8-14(16)11-13/h6-8,11-12,17H,4-5,9-10H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide?
N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide has a molecular weight of 266.36 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide is sourced from PubChem (CID 43420356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).