N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide

C16H24N2O2 — CID 113051892

IUPACN-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide
SMILESCCCN(CCNC(=O)Cc1ccc(C)cc1)C(C)=O
InChIInChI=1S/C16H24N2O2/c1-4-10-18(14(3)19)11-9-17-16(20)12-15-7-5-13(2)6-8-15/h5-8H,4,9-12H2,1-3H3,(H,17,20)
InChIKeyPEJPNWWQSVJDBR-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.91
Rot. Bonds7

About N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide

N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide (PubChem CID 113051892) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide
PubChem CID113051892
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide
SMILESCCCN(CCNC(=O)Cc1ccc(C)cc1)C(C)=O
InChIInChI=1S/C16H24N2O2/c1-4-10-18(14(3)19)11-9-17-16(20)12-15-7-5-13(2)6-8-15/h5-8H,4,9-12H2,1-3H3,(H,17,20)
InChIKeyPEJPNWWQSVJDBR-UHFFFAOYSA-N
XLogP1.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[acetyl-[(4-methylphenyl)methyl]amino]ethyl]-2-phenylacetamide
CID 113054348
N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(4-methylphenyl)acetamide
CID 113053917
N-[2-[acetyl(propyl)amino]ethyl]-3-phenylpropanamide
CID 113051865
N-[2-[acetyl(2-methoxyethyl)amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 113053170
N-[2-(N-acetyl-3,4-dimethylanilino)ethyl]-2-(4-methylphenyl)acetamide
CID 113057921
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 113053547
N-[3-(dimethylamino)propyl]-2-(4-methylphenyl)acetamide
CID 4080384
N-[2-[N-acetyl-4-(trifluoromethyl)anilino]ethyl]-2-(4-methylphenyl)acetamide
CID 113061521
N-[2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]ethyl]butanamide
CID 113055720
N-[2-[2-(dimethylamino)ethyl-methylsulfonylamino]ethyl]-2-(4-methylphenyl)acetamide
CID 113066272
N-[2-[acetyl(1,3-benzodioxol-5-yl)amino]ethyl]-2-(4-methylphenyl)acetamide
CID 113062988
N-[2-[acetyl-[(2-chlorophenyl)methyl]amino]ethyl]-2-(4-chlorophenyl)acetamide
CID 113054765

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide (CID 113051892) is N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide is CCCN(CCNC(=O)Cc1ccc(C)cc1)C(C)=O.
What is the InChIKey of N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide?
The InChIKey is PEJPNWWQSVJDBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-10-18(14(3)19)11-9-17-16(20)12-15-7-5-13(2)6-8-15/h5-8H,4,9-12H2,1-3H3,(H,17,20).
What are the key properties of N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide?
N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(propyl)amino]ethyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 113051892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).