N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide

C18H21FN2O2 — CID 110877219

IUPACN-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide
SMILESO=C(CN(CCO)c1ccccc1)NCCc1ccc(F)cc1
InChIInChI=1S/C18H21FN2O2/c19-16-8-6-15(7-9-16)10-11-20-18(23)14-21(12-13-22)17-4-2-1-3-5-17/h1-9,22H,10-14H2,(H,20,23)
InChIKeyULUZADHYYHYIRM-UHFFFAOYSA-N
MW316.38 g/mol
LogP1.98
Rot. Bonds8

About N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide

N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide (PubChem CID 110877219) has the molecular formula C18H21FN2O2 and a molecular weight of 316.38 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide
PubChem CID110877219
Molecular FormulaC18H21FN2O2
Molecular Weight316.38 g/mol
Exact Mass316.16
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide
SMILESO=C(CN(CCO)c1ccccc1)NCCc1ccc(F)cc1
InChIInChI=1S/C18H21FN2O2/c19-16-8-6-15(7-9-16)10-11-20-18(23)14-21(12-13-22)17-4-2-1-3-5-17/h1-9,22H,10-14H2,(H,20,23)
InChIKeyULUZADHYYHYIRM-UHFFFAOYSA-N
XLogP1.98
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide
CID 110877202
2-[ethyl(2-hydroxyethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 60685466
N-ethyl-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110880306
2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 78787355
2-(N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-4-methoxyanilino)acetic acid
CID 25219956
2-(N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]anilino)acetic acid
CID 25219996
2-[N-(3-hydroxypropyl)anilino]-N-propylacetamide
CID 111859978
N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
CID 3117526
N-[2-(4-fluorophenyl)ethyl]-4-phenylbutanamide
CID 2288121
2-[(4-fluorophenyl)methyl-methylsulfonylamino]-N-(2-phenylethyl)acetamide
CID 113150994
N-[2-(4-fluorophenyl)ethyl]-3-(2-phenylethylamino)propanamide
CID 109024236
1,1-dibenzyl-3-[2-(4-fluorophenyl)ethyl]urea
CID 108902120

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide (CID 110877219) is N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide is O=C(CN(CCO)c1ccccc1)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide?
The InChIKey is ULUZADHYYHYIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2/c19-16-8-6-15(7-9-16)10-11-20-18(23)14-21(12-13-22)17-4-2-1-3-5-17/h1-9,22H,10-14H2,(H,20,23).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide?
N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide has a molecular weight of 316.38 g/mol, XLogP of 1.98, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide is sourced from PubChem (CID 110877219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).