2-(2-methylphenyl)-N,N-dipropylacetamide

C15H23NO — CID 86977350

IUPAC2-(2-methylphenyl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1ccccc1C
InChIInChI=1S/C15H23NO/c1-4-10-16(11-5-2)15(17)12-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3
InChIKeyISJHFTANRILFGZ-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.19
Rot. Bonds6

About 2-(2-methylphenyl)-N,N-dipropylacetamide

2-(2-methylphenyl)-N,N-dipropylacetamide (PubChem CID 86977350) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N,N-dipropylacetamide
PubChem CID86977350
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-(2-methylphenyl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1ccccc1C
InChIInChI=1S/C15H23NO/c1-4-10-16(11-5-2)15(17)12-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3
InChIKeyISJHFTANRILFGZ-UHFFFAOYSA-N
XLogP3.19
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-hydroxyethyl)-2-(2-methylphenyl)-N-propylacetamide
CID 60656670
N-acetyl-2-(2-methylphenyl)-N-propylacetamide
CID 151742492
2-(2-methylphenyl)-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79702981
2-[2-(dipropylamino)-2-oxoethyl]benzoic acid
CID 112568579
3-[(2-methylphenyl)methylamino]-N,N-dipropylpropanamide
CID 109019300
2-(2-methylphenyl)ethyl-propylcarbamic acid
CID 144705989
2-[(2-methylphenyl)methyl-methylsulfonylamino]-N,N-dipropylacetamide
CID 113150551
N-ethyl-N-(2-hydroxy-2-methylpropyl)-2-(2-methylphenyl)acetamide
CID 79386743
N-ethyl-2-(2-methylphenyl)-N-prop-2-ynylacetamide
CID 78970730
N-(4-aminophenyl)-2-(2-methylphenyl)-N-propylacetamide
CID 63234107
2-[2-(aminomethyl)phenyl]-N-[2-(dimethylamino)ethyl]-N-propylacetamide
CID 81321874
2-[[2-(2-fluorophenyl)acetyl]-propylamino]acetic acid
CID 61011390

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N,N-dipropylacetamide?
The IUPAC name of 2-(2-methylphenyl)-N,N-dipropylacetamide (CID 86977350) is 2-(2-methylphenyl)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N,N-dipropylacetamide?
The canonical SMILES for 2-(2-methylphenyl)-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cc1ccccc1C.
What is the InChIKey of 2-(2-methylphenyl)-N,N-dipropylacetamide?
The InChIKey is ISJHFTANRILFGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-4-10-16(11-5-2)15(17)12-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3.
What are the key properties of 2-(2-methylphenyl)-N,N-dipropylacetamide?
2-(2-methylphenyl)-N,N-dipropylacetamide has a molecular weight of 233.36 g/mol, XLogP of 3.19, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N,N-dipropylacetamide is sourced from PubChem (CID 86977350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).