N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide

C14H20FN3O2 — CID 43401425

IUPACN-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCCc1cccc(F)c1
InChIInChI=1S/C14H20FN3O2/c1-3-16-14(20)18-13(19)10(2)17-8-7-11-5-4-6-12(15)9-11/h4-6,9-10,17H,3,7-8H2,1-2H3,(H2,16,18,19,20)
InChIKeyUQSHZWNXWBEILD-UHFFFAOYSA-N
MW281.33 g/mol
LogP1.19
Rot. Bonds6

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

N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide (PubChem CID 43401425) has the molecular formula C14H20FN3O2 and a molecular weight of 281.33 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
PubChem CID43401425
Molecular FormulaC14H20FN3O2
Molecular Weight281.33 g/mol
Exact Mass281.15
IUPAC NameN-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide
SMILESCCNC(=O)NC(=O)C(C)NCCc1cccc(F)c1
InChIInChI=1S/C14H20FN3O2/c1-3-16-14(20)18-13(19)10(2)17-8-7-11-5-4-6-12(15)9-11/h4-6,9-10,17H,3,7-8H2,1-2H3,(H2,16,18,19,20)
InChIKeyUQSHZWNXWBEILD-UHFFFAOYSA-N
XLogP1.19
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-fluorophenyl)ethylamino]-N-propan-2-ylpropanamide
CID 43401436
ethyl 2-[2-(3-fluorophenyl)ethylamino]propanoate
CID 55134787
N-(ethylcarbamoyl)-2-(2-pyridin-4-ylethylamino)propanamide
CID 60902698
N,N-diethyl-2-[2-(3-fluorophenyl)ethylamino]propanamide
CID 43420356
2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 43401439
N-(ethylcarbamoyl)-2-[(3-methylphenyl)methylamino]propanamide
CID 60734036
(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide
CID 61145838
2-[2-(3-fluorophenyl)ethylamino]-N'-hydroxypropanimidamide
CID 77030267
N-(ethylcarbamoyl)-2-[2-(furan-2-yl)ethylamino]propanamide
CID 60638480
(2S)-N-[2-(3-fluorophenyl)ethyl]butan-2-amine
CID 93246045
N-[2-(3-fluorophenyl)ethyl]butan-2-amine
CID 43565886
2-amino-N-[2-(3-fluorophenyl)ethyl]-3-methylbutanamide
CID 43566282

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide (CID 43401425) is N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide is CCNC(=O)NC(=O)C(C)NCCc1cccc(F)c1.
What is the InChIKey of N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide?
The InChIKey is UQSHZWNXWBEILD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O2/c1-3-16-14(20)18-13(19)10(2)17-8-7-11-5-4-6-12(15)9-11/h4-6,9-10,17H,3,7-8H2,1-2H3,(H2,16,18,19,20).
What are the key properties of N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide?
N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide has a molecular weight of 281.33 g/mol, XLogP of 1.19, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-[2-(3-fluorophenyl)ethylamino]propanamide is sourced from PubChem (CID 43401425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).