2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide

C15H24N2O — CID 61219195

IUPAC2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide
SMILESCC(C)c1ccc(C(C)NC(C)(C)C(N)=O)cc1
InChIInChI=1S/C15H24N2O/c1-10(2)12-6-8-13(9-7-12)11(3)17-15(4,5)14(16)18/h6-11,17H,1-5H3,(H2,16,18)
InChIKeyCGRKOODBECOPEC-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.72
Rot. Bonds5

About 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide

2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide (PubChem CID 61219195) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide.

Molecular Properties

Compound Name2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide
PubChem CID61219195
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide
SMILESCC(C)c1ccc(C(C)NC(C)(C)C(N)=O)cc1
InChIInChI=1S/C15H24N2O/c1-10(2)12-6-8-13(9-7-12)11(3)17-15(4,5)14(16)18/h6-11,17H,1-5H3,(H2,16,18)
InChIKeyCGRKOODBECOPEC-UHFFFAOYSA-N
XLogP2.72
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-[1-[4-(trifluoromethyl)phenyl]ethylamino]propanamide
CID 61219595
2-methyl-2-[1-(4-nitrophenyl)ethylamino]propanamide
CID 61219970
2-methyl-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
CID 61220351
2-[1-(4-hydroxy-3-methoxyphenyl)ethylamino]-2-methylpropanamide
CID 61210890
2-[1-(2,6-dihydroxyphenyl)ethylamino]-2-methylpropanamide
CID 107710838
(2S)-2-amino-3,3-dimethyl-N-[1-(4-propan-2-ylphenyl)ethyl]butanamide
CID 61178572
methyl 2-[1-(4-iodophenyl)ethylamino]-2-methylpropanoate
CID 43787152
2-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylpropanamide
CID 61336100
2,2-dimethyl-3-(1-phenylethylamino)propanamide
CID 115667918
2-[(1-anilino-1-oxopropan-2-yl)amino]-2-methylpropanamide
CID 61219044
[2-methyl-2-(4-propan-2-ylphenyl)propyl]urea
CID 115168740
2-(diethylamino)-2-(4-propan-2-ylphenyl)acetamide
CID 112510339

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide?
The IUPAC name of 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide (CID 61219195) is 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide.
What is the SMILES notation for 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide?
The canonical SMILES for 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide is CC(C)c1ccc(C(C)NC(C)(C)C(N)=O)cc1.
What is the InChIKey of 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide?
The InChIKey is CGRKOODBECOPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)12-6-8-13(9-7-12)11(3)17-15(4,5)14(16)18/h6-11,17H,1-5H3,(H2,16,18).
What are the key properties of 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide?
2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]propanamide is sourced from PubChem (CID 61219195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).