N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide

C15H24N2O — CID 137469739

IUPACN-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(N(CCCN(C)C)C(C)=O)cc1
InChIInChI=1S/C15H24N2O/c1-5-14-7-9-15(10-8-14)17(13(2)18)12-6-11-16(3)4/h7-10H,5-6,11-12H2,1-4H3
InChIKeyWBEVSWATJRJQKZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.55
Rot. Bonds6

About N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide

N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide (PubChem CID 137469739) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide
PubChem CID137469739
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(N(CCCN(C)C)C(C)=O)cc1
InChIInChI=1S/C15H24N2O/c1-5-14-7-9-15(10-8-14)17(13(2)18)12-6-11-16(3)4/h7-10H,5-6,11-12H2,1-4H3
InChIKeyWBEVSWATJRJQKZ-UHFFFAOYSA-N
XLogP2.55
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide (CID 137469739) is N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide is CCc1ccc(N(CCCN(C)C)C(C)=O)cc1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide?
The InChIKey is WBEVSWATJRJQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-14-7-9-15(10-8-14)17(13(2)18)12-6-11-16(3)4/h7-10H,5-6,11-12H2,1-4H3.
What are the key properties of N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide?
N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.55, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 137469739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).