N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide

C15H23N3O2 — CID 27068519

IUPACN-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide
SMILESCCCCN(C)CC(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C15H23N3O2/c1-4-5-9-18(3)11-15(20)17-14-8-6-7-13(10-14)16-12(2)19/h6-8,10H,4-5,9,11H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyBYXMUFDOQORWDQ-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.32
Rot. Bonds7

About N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide

N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide (PubChem CID 27068519) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide
PubChem CID27068519
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide
SMILESCCCCN(C)CC(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C15H23N3O2/c1-4-5-9-18(3)11-15(20)17-14-8-6-7-13(10-14)16-12(2)19/h6-8,10H,4-5,9,11H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyBYXMUFDOQORWDQ-UHFFFAOYSA-N
XLogP2.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(3-acetamidoanilino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
CID 17431317
3-[butyl(methyl)amino]-N-[3-(dimethylamino)phenyl]propanamide
CID 108795391
N-(4-bromo-3-methylphenyl)-2-[butyl(methyl)amino]acetamide
CID 109006163
3-[[2-[butyl(methyl)amino]acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 27152993
2-[butyl(methyl)amino]-N-(4-propan-2-ylphenyl)acetamide
CID 55353682
2-[butyl(methyl)amino]-N-(3-chloro-4-methoxyphenyl)acetamide
CID 31477725
N-[4-(3-acetamidophenyl)phenyl]-5-[methyl(pentyl)amino]pentanamide
CID 25029477
N-(3-acetamidophenyl)-2-butylsulfanylacetamide
CID 31858519
N-(3-aminophenyl)-2-(dibutylamino)acetamide
CID 28982406
3-[methyl(undecyl)amino]-N-[3-[[3-[3-[methyl(undecyl)amino]propanoylamino]phenyl]methyl]phenyl]propanamide
CID 139955149
N-[3-(aminomethyl)phenyl]-2-[3-(dimethylamino)propyl-methylamino]acetamide
CID 63694626
N-(3-acetamidophenyl)-2-[[2-[2-cyanoethyl(methyl)amino]-2-oxoethyl]-methylamino]acetamide
CID 51087127

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide (CID 27068519) is N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide is CCCCN(C)CC(=O)Nc1cccc(NC(C)=O)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide?
The InChIKey is BYXMUFDOQORWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-4-5-9-18(3)11-15(20)17-14-8-6-7-13(10-14)16-12(2)19/h6-8,10H,4-5,9,11H2,1-3H3,(H,16,19)(H,17,20).
What are the key properties of N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide?
N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide has a molecular weight of 277.37 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-[butyl(methyl)amino]acetamide is sourced from PubChem (CID 27068519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).