N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide

C14H20N2O3 — CID 62334507

IUPACN-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(C)CC(C)O)c1
InChIInChI=1S/C14H20N2O3/c1-10(17)8-16(3)9-14(19)15-13-6-4-5-12(7-13)11(2)18/h4-7,10,17H,8-9H2,1-3H3,(H,15,19)
InChIKeyMBXPJNSWTQIDQM-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.14
Rot. Bonds6

About N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide

N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide (PubChem CID 62334507) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide
PubChem CID62334507
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CN(C)CC(C)O)c1
InChIInChI=1S/C14H20N2O3/c1-10(17)8-16(3)9-14(19)15-13-6-4-5-12(7-13)11(2)18/h4-7,10,17H,8-9H2,1-3H3,(H,15,19)
InChIKeyMBXPJNSWTQIDQM-UHFFFAOYSA-N
XLogP1.14
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide (CID 62334507) is N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide is CC(=O)c1cccc(NC(=O)CN(C)CC(C)O)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide?
The InChIKey is MBXPJNSWTQIDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(17)8-16(3)9-14(19)15-13-6-4-5-12(7-13)11(2)18/h4-7,10,17H,8-9H2,1-3H3,(H,15,19).
What are the key properties of N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide?
N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[2-hydroxypropyl(methyl)amino]acetamide is sourced from PubChem (CID 62334507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).