N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

C14H21FN2O2 — CID 60693543

IUPACN-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1cc(F)ccc1C
InChIInChI=1S/C14H21FN2O2/c1-3-6-17(7-8-18)10-14(19)16-13-9-12(15)5-4-11(13)2/h4-5,9,18H,3,6-8,10H2,1-2H3,(H,16,19)
InChIKeySGSVXWXFWNMZNN-UHFFFAOYSA-N
MW268.33 g/mol
LogP1.78
Rot. Bonds7

About N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (PubChem CID 60693543) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
PubChem CID60693543
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC NameN-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1cc(F)ccc1C
InChIInChI=1S/C14H21FN2O2/c1-3-6-17(7-8-18)10-14(19)16-13-9-12(15)5-4-11(13)2/h4-5,9,18H,3,6-8,10H2,1-2H3,(H,16,19)
InChIKeySGSVXWXFWNMZNN-UHFFFAOYSA-N
XLogP1.78
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butyl(2-hydroxyethyl)amino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 60689165
3-[[2-(2,5-dimethylanilino)-2-oxoethyl]-(2-hydroxyethyl)amino]propanoic acid
CID 82326666
3-[[2-(2,5-dimethylanilino)-2-oxoethyl]-propylamino]propanoic acid
CID 82326667
N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 61424715
2-[butyl(2-hydroxyethyl)amino]-N-(2-methylphenyl)acetamide
CID 60688995
2-[[2-(5-fluoro-2-methylanilino)-2-oxoethyl]-(2-methylpropyl)amino]acetic acid
CID 63064165
2-[(2-bromo-4-fluorophenyl)methyl-propylamino]-N-(2-methylphenyl)acetamide
CID 30794360
2-[ethyl-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 18085874
2-[(5-fluoro-2-methylphenyl)methyl-propylamino]ethanol
CID 115970191
N-(5-amino-2-methylphenyl)-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 107478839
N-[2-(4-fluorophenyl)ethyl]-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
CID 9039149
2-[(5-bromothiophen-2-yl)methyl-ethylamino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 18191770

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (CID 60693543) is N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is CCCN(CCO)CC(=O)Nc1cc(F)ccc1C.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The InChIKey is SGSVXWXFWNMZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-3-6-17(7-8-18)10-14(19)16-13-9-12(15)5-4-11(13)2/h4-5,9,18H,3,6-8,10H2,1-2H3,(H,16,19).
What are the key properties of N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide has a molecular weight of 268.33 g/mol, XLogP of 1.78, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is sourced from PubChem (CID 60693543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).