N-[4-(diethylamino)phenyl]-2-methylpropanamide

C14H22N2O — CID 732301

IUPACN-[4-(diethylamino)phenyl]-2-methylpropanamide
SMILESCCN(CC)c1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-5-16(6-2)13-9-7-12(8-10-13)15-14(17)11(3)4/h7-11H,5-6H2,1-4H3,(H,15,17)
InChIKeyYFAUXYURAHJHNL-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.13
Rot. Bonds5

About N-[4-(diethylamino)phenyl]-2-methylpropanamide

N-[4-(diethylamino)phenyl]-2-methylpropanamide (PubChem CID 732301) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-methylpropanamide
PubChem CID732301
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[4-(diethylamino)phenyl]-2-methylpropanamide
SMILESCCN(CC)c1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-5-16(6-2)13-9-7-12(8-10-13)15-14(17)11(3)4/h7-11H,5-6H2,1-4H3,(H,15,17)
InChIKeyYFAUXYURAHJHNL-UHFFFAOYSA-N
XLogP3.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-methylpropanamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-methylpropanamide (CID 732301) is N-[4-(diethylamino)phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-methylpropanamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-methylpropanamide is CCN(CC)c1ccc(NC(=O)C(C)C)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-methylpropanamide?
The InChIKey is YFAUXYURAHJHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-5-16(6-2)13-9-7-12(8-10-13)15-14(17)11(3)4/h7-11H,5-6H2,1-4H3,(H,15,17).
What are the key properties of N-[4-(diethylamino)phenyl]-2-methylpropanamide?
N-[4-(diethylamino)phenyl]-2-methylpropanamide has a molecular weight of 234.34 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2-methylpropanamide is sourced from PubChem (CID 732301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).