2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide

C15H24N2O — CID 62659574

IUPAC2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NCCNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(2)16-10-11-17-14(18)15(3,4)13-8-6-5-7-9-13/h5-9,12,16H,10-11H2,1-4H3,(H,17,18)
InChIKeyMFDRDQZTPWSHQU-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.08
Rot. Bonds6

About 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide

2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide (PubChem CID 62659574) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide.

Molecular Properties

Compound Name2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide
PubChem CID62659574
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NCCNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-12(2)16-10-11-17-14(18)15(3,4)13-8-6-5-7-9-13/h5-9,12,16H,10-11H2,1-4H3,(H,17,18)
InChIKeyMFDRDQZTPWSHQU-UHFFFAOYSA-N
XLogP2.08
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
CID 110678562
N-(4-bromobutyl)-2-methyl-2-phenylpropanamide
CID 106845643
N-[(2R)-2-(ethylamino)propyl]-2-methyl-2-phenylpropanamide;hydrochloride
CID 120653206
N-(2-amino-3-hydroxybutyl)-2-methyl-2-phenylpropanamide
CID 64539763
2-methyl-N-[2-(2-methylphenyl)ethyl]-2-phenylpropanamide
CID 46531773
N-(3,3-dimethyl-2-oxobutyl)-2-methyl-2-phenylpropanamide
CID 64991414
2-methyl-2-phenyl-N-(3,3,3-trifluoro-2-hydroxypropyl)propanamide
CID 103730656
2-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]-2-phenylpropanamide
CID 46420935
N-[2-[(2-amino-2-phenylpropanoyl)amino]ethyl]-2,2-dimethylpropanamide
CID 120591033
2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
CID 114618287
N-(1-aminopropan-2-yl)-2-methyl-2-phenylpropanamide
CID 63731541
N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
CID 65114444

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide?
The IUPAC name of 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide (CID 62659574) is 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide.
What is the SMILES notation for 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide?
The canonical SMILES for 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide is CC(C)NCCNC(=O)C(C)(C)c1ccccc1.
What is the InChIKey of 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide?
The InChIKey is MFDRDQZTPWSHQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(2)16-10-11-17-14(18)15(3,4)13-8-6-5-7-9-13/h5-9,12,16H,10-11H2,1-4H3,(H,17,18).
What are the key properties of 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide?
2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide is sourced from PubChem (CID 62659574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).