N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide

C13H19FN2O — CID 60683040

IUPACN-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide
SMILESCCN(C(=O)CNC(C)C)c1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-4-16(13(17)9-15-10(2)3)12-7-5-11(14)6-8-12/h5-8,10,15H,4,9H2,1-3H3
InChIKeyOMUYMCMNKVVBBF-UHFFFAOYSA-N
MW238.31 g/mol
LogP2.18
Rot. Bonds5

About N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide

N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide (PubChem CID 60683040) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide
PubChem CID60683040
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC NameN-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide
SMILESCCN(C(=O)CNC(C)C)c1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-4-16(13(17)9-15-10(2)3)12-7-5-11(14)6-8-12/h5-8,10,15H,4,9H2,1-3H3
InChIKeyOMUYMCMNKVVBBF-UHFFFAOYSA-N
XLogP2.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-2-[[2-(N-ethyl-4-fluoroanilino)-2-oxoethyl]amino]acetic acid
CID 62694873
N-ethyl-N-(4-fluorophenyl)-4-hydroxypentanamide
CID 79192647
N-ethyl-N-(4-fluorophenyl)-3,3-dimethylbutanamide
CID 78806080
N-ethyl-N-(4-fluorophenyl)hexanamide
CID 78806862
(2S)-2-amino-N-ethyl-N-(4-fluorophenyl)propanamide;hydrochloride
CID 119271831
(3Z)-3-amino-N-ethyl-N-(4-fluorophenyl)-3-hydroxyiminopropanamide
CID 55135186
3-chloro-1-ethyl-1-(4-fluorophenyl)urea
CID 87646855
N-butyl-N-phenyl-2-(propan-2-ylamino)acetamide
CID 64584219
N-[2-(4-fluorophenyl)ethyl]-N-methyl-2-(propan-2-ylamino)acetamide
CID 115158335
N-ethyl-N-(4-fluorophenyl)-2-(4-hydroxybutan-2-ylsulfanyl)acetamide
CID 66137274
3-[2-(N-ethyl-4-fluoroanilino)-2-oxoethyl]sulfanylbutanoic acid
CID 66138051
2-[2-(N-ethyl-4-fluoroanilino)-2-oxoethyl]sulfanyl-3-methylbutanoic acid
CID 105353735

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide (CID 60683040) is N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide is CCN(C(=O)CNC(C)C)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide?
The InChIKey is OMUYMCMNKVVBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-4-16(13(17)9-15-10(2)3)12-7-5-11(14)6-8-12/h5-8,10,15H,4,9H2,1-3H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide?
N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide has a molecular weight of 238.31 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide is sourced from PubChem (CID 60683040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).