2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide

C15H24N2O — CID 106312073

IUPAC2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide
SMILESCCCCCN(C)C(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C15H24N2O/c1-4-5-6-11-17(3)15(18)14(16)13-9-7-12(2)8-10-13/h7-10,14H,4-6,11,16H2,1-3H3
InChIKeyPCZRBABELCCEJI-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.64
Rot. Bonds6

About 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide

2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide (PubChem CID 106312073) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide.

Molecular Properties

Compound Name2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide
PubChem CID106312073
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide
SMILESCCCCCN(C)C(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C15H24N2O/c1-4-5-6-11-17(3)15(18)14(16)13-9-7-12(2)8-10-13/h7-10,14H,4-6,11,16H2,1-3H3
InChIKeyPCZRBABELCCEJI-UHFFFAOYSA-N
XLogP2.64
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-methyl-2-(4-methylphenyl)-N-propylacetamide
CID 106151263
2-amino-N-methyl-N-(2-methylbutyl)-2-(4-methylphenyl)acetamide
CID 106151480
2-amino-N-[2-(4-bromophenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 120668214
2-amino-N-methyl-N-(2-methylbutyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668393
2-amino-N-[2-(ethylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 106151379
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)acetamide;dihydrochloride
CID 120670650
2-amino-N-methyl-2-(4-methylphenyl)-N-pentan-3-ylacetamide
CID 114172087
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-thiophen-2-ylethyl)acetamide
CID 106151574
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-phenylmethoxyethyl)acetamide;hydrochloride
CID 120669222
2-amino-N-methyl-2-(4-methylphenyl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 106151730
2-amino-N-butan-2-yl-N-ethyl-2-(4-methylphenyl)acetamide
CID 106312072
N-methyl-N-pentyl-2-phenylpropanamide
CID 90809964

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide?
The IUPAC name of 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide (CID 106312073) is 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide.
What is the SMILES notation for 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide?
The canonical SMILES for 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide is CCCCCN(C)C(=O)C(N)c1ccc(C)cc1.
What is the InChIKey of 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide?
The InChIKey is PCZRBABELCCEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-5-6-11-17(3)15(18)14(16)13-9-7-12(2)8-10-13/h7-10,14H,4-6,11,16H2,1-3H3.
What are the key properties of 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide?
2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide has a molecular weight of 248.37 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide is sourced from PubChem (CID 106312073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).