N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide

C16H24N2O3 — CID 110935819

IUPACN-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
SMILESCCCN(CCO)CCC(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-3-9-18(11-12-19)10-8-16(21)17-15-6-4-14(5-7-15)13(2)20/h4-7,19H,3,8-12H2,1-2H3,(H,17,21)
InChIKeyYAYOINAGHRJZSR-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.92
Rot. Bonds9

About N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide

N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide (PubChem CID 110935819) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
PubChem CID110935819
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
SMILESCCCN(CCO)CCC(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-3-9-18(11-12-19)10-8-16(21)17-15-6-4-14(5-7-15)13(2)20/h4-7,19H,3,8-12H2,1-2H3,(H,17,21)
InChIKeyYAYOINAGHRJZSR-UHFFFAOYSA-N
XLogP1.92
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-hydroxyethyl(propyl)amino]-N-phenylpropanamide
CID 62016603
N-(4-chlorophenyl)-3-(dipropylamino)propanamide
CID 109033132
3-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(4-acetylphenyl)propanamide
CID 24588858
3-(dipropylamino)-N-phenylpropanamide
CID 52579960
N-(3-aminophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
CID 61424662
N-(3,4-dimethylphenyl)-3-(dipropylamino)propanamide
CID 109033116
N-(4-aminophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 61425121
N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
CID 60774874
N-(4-acetylphenyl)-3-(N-ethyl-4-fluoroanilino)propanamide
CID 56525325
N-(4-aminophenyl)-3-(dibutylamino)propanamide
CID 28982366
N-(4-cyanophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60691467
N-(4-acetylphenyl)-3-[3-(dimethylamino)propylamino]propanamide
CID 109017139

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide (CID 110935819) is N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide is CCCN(CCO)CCC(=O)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The InChIKey is YAYOINAGHRJZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-9-18(11-12-19)10-8-16(21)17-15-6-4-14(5-7-15)13(2)20/h4-7,19H,3,8-12H2,1-2H3,(H,17,21).
What are the key properties of N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide has a molecular weight of 292.38 g/mol, XLogP of 1.92, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide is sourced from PubChem (CID 110935819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).