N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide

C16H20ClFN2O — CID 46444172

IUPACN-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
SMILESCC(C1CC1)N(CC(=O)Nc1cc(Cl)ccc1F)C1CC1
InChIInChI=1S/C16H20ClFN2O/c1-10(11-2-3-11)20(13-5-6-13)9-16(21)19-15-8-12(17)4-7-14(15)18/h4,7-8,10-11,13H,2-3,5-6,9H2,1H3,(H,19,21)
InChIKeyXLFLXGYBDMYDSA-UHFFFAOYSA-N
MW310.80 g/mol
LogP3.68
Rot. Bonds6

About N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide

N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide (PubChem CID 46444172) has the molecular formula C16H20ClFN2O and a molecular weight of 310.80 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
PubChem CID46444172
Molecular FormulaC16H20ClFN2O
Molecular Weight310.80 g/mol
Exact Mass310.12
IUPAC NameN-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
SMILESCC(C1CC1)N(CC(=O)Nc1cc(Cl)ccc1F)C1CC1
InChIInChI=1S/C16H20ClFN2O/c1-10(11-2-3-11)20(13-5-6-13)9-16(21)19-15-8-12(17)4-7-14(15)18/h4,7-8,10-11,13H,2-3,5-6,9H2,1H3,(H,19,21)
InChIKeyXLFLXGYBDMYDSA-UHFFFAOYSA-N
XLogP3.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.80
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 46602371
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 43063375
2-[cyclopropyl-[2-(2,4-dichloroanilino)-2-oxoethyl]amino]propanoic acid
CID 122100904
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-(4-methyl-2-nitrophenyl)acetamide
CID 46444137
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-(phenylcarbamoyl)acetamide
CID 86983861
N-(5-amino-2-fluorophenyl)-2-[cyclopropyl(3-methylbutyl)amino]acetamide
CID 78973770
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[3-(diethylsulfamoyl)phenyl]acetamide
CID 46602367
2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-(5-chloro-2-fluorophenyl)acetamide
CID 18557378
N-(5-chloro-2-fluorophenyl)-2-hydroxyacetamide
CID 16769009
N-(5-chloro-2-fluorophenyl)-2-(N,3,5-trimethylanilino)acetamide
CID 52689468
2-[cycloheptyl(methyl)amino]-N-(2,5-difluorophenyl)acetamide
CID 16577767
2-[[2-(5-chloro-2-fluoroanilino)-2-oxoethyl]-methylamino]-N-(2-chlorophenyl)acetamide
CID 9037147

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide (CID 46444172) is N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide is CC(C1CC1)N(CC(=O)Nc1cc(Cl)ccc1F)C1CC1.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide?
The InChIKey is XLFLXGYBDMYDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClFN2O/c1-10(11-2-3-11)20(13-5-6-13)9-16(21)19-15-8-12(17)4-7-14(15)18/h4,7-8,10-11,13H,2-3,5-6,9H2,1H3,(H,19,21).
What are the key properties of N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide?
N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide has a molecular weight of 310.80 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide is sourced from PubChem (CID 46444172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).