2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide

C14H20N2O3 — CID 78916891

IUPAC2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide
SMILESCCCN(CC(=O)NC)C(=O)Cc1ccccc1O
InChIInChI=1S/C14H20N2O3/c1-3-8-16(10-13(18)15-2)14(19)9-11-6-4-5-7-12(11)17/h4-7,17H,3,8-10H2,1-2H3,(H,15,18)
InChIKeyJHFQDHUFMDCCFC-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.92
Rot. Bonds6

About 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide

2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide (PubChem CID 78916891) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide
PubChem CID78916891
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide
SMILESCCCN(CC(=O)NC)C(=O)Cc1ccccc1O
InChIInChI=1S/C14H20N2O3/c1-3-8-16(10-13(18)15-2)14(19)9-11-6-4-5-7-12(11)17/h4-7,17H,3,8-10H2,1-2H3,(H,15,18)
InChIKeyJHFQDHUFMDCCFC-UHFFFAOYSA-N
XLogP0.92
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2Z)-2-amino-2-hydroxyiminoethyl]-2-(2-hydroxyphenyl)-N-propylacetamide
CID 80740760
N-(cyanomethyl)-2-(2-hydroxyphenyl)-N-propylacetamide
CID 80741251
N,N-dibutyl-2-(2-hydroxyphenyl)acetamide
CID 78916820
2-(2-methylphenyl)-N,N-dipropylacetamide
CID 86977350
2-[(2-bromoacetyl)-propylamino]-N-methylacetamide
CID 63680296
2-[[2-(2-fluorophenyl)acetyl]-propylamino]acetic acid
CID 61011390
4-[[2-(methylamino)-2-oxoethyl]-propylamino]-4-oxobutanoic acid
CID 61041902
N-butyl-N-(2-hydroxyethyl)-2-(2-hydroxyphenyl)acetamide
CID 80741482
2-fluoro-N-[2-(methylamino)-2-oxoethyl]-N-propylbenzamide
CID 61046623
methyl 2-[[2-(2-fluorophenyl)acetyl]-propylamino]acetate
CID 55005808
N-(2-hydroxyethyl)-2-(2-methylphenyl)-N-propylacetamide
CID 60656670
2-[[2-(2-nitrophenyl)acetyl]-propylamino]acetic acid
CID 61012209

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide (CID 78916891) is 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide is CCCN(CC(=O)NC)C(=O)Cc1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide?
The InChIKey is JHFQDHUFMDCCFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-8-16(10-13(18)15-2)14(19)9-11-6-4-5-7-12(11)17/h4-7,17H,3,8-10H2,1-2H3,(H,15,18).
What are the key properties of 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide?
2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide has a molecular weight of 264.32 g/mol, XLogP of 0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-N-[2-(methylamino)-2-oxoethyl]-N-propylacetamide is sourced from PubChem (CID 78916891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).