N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide

C16H23FN2O2 — CID 91836143

IUPACN-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide
SMILESCN(CC(=O)NCCc1ccc(F)cc1)CC1(C)COC1
InChIInChI=1S/C16H23FN2O2/c1-16(11-21-12-16)10-19(2)9-15(20)18-8-7-13-3-5-14(17)6-4-13/h3-6H,7-12H2,1-2H3,(H,18,20)
InChIKeyPHABXEQKRPSDPF-UHFFFAOYSA-N
MW294.37 g/mol
LogP1.45
Rot. Bonds7

About N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide

N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide (PubChem CID 91836143) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide
PubChem CID91836143
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide
SMILESCN(CC(=O)NCCc1ccc(F)cc1)CC1(C)COC1
InChIInChI=1S/C16H23FN2O2/c1-16(11-21-12-16)10-19(2)9-15(20)18-8-7-13-3-5-14(17)6-4-13/h3-6H,7-12H2,1-2H3,(H,18,20)
InChIKeyPHABXEQKRPSDPF-UHFFFAOYSA-N
XLogP1.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-3-methyloxetane-3-carboxamide
CID 146022376
N-[2-(4-fluorophenyl)ethyl]-2-[2-hydroxypropyl(methyl)amino]acetamide
CID 62334683
2-[(4-bromophenyl)methyl-methylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 2541418
2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 18088813
2-(4-fluorophenyl)-N-[(3-methyloxetan-3-yl)methyl]acetamide
CID 78957558
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 9037832
N-[2-(4-fluorophenyl)ethyl]-2-[methyl(thian-4-yl)amino]acetamide
CID 91838890
2-[(2,4-dimethylphenyl)methyl-methylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 18088505
2-[(2,4-dichlorophenyl)methyl-methylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 9196994
N-[2-(4-fluorophenyl)ethyl]-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 18088830
2-[acetyl(tert-butyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 113166097
2-[2-(4-chlorophenoxy)ethyl-methylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 18083569

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide (CID 91836143) is N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide is CN(CC(=O)NCCc1ccc(F)cc1)CC1(C)COC1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide?
The InChIKey is PHABXEQKRPSDPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-16(11-21-12-16)10-19(2)9-15(20)18-8-7-13-3-5-14(17)6-4-13/h3-6H,7-12H2,1-2H3,(H,18,20).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide?
N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide has a molecular weight of 294.37 g/mol, XLogP of 1.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-[methyl-[(3-methyloxetan-3-yl)methyl]amino]acetamide is sourced from PubChem (CID 91836143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).