2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide

C15H25N3O2 — CID 60992003

IUPAC2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide
SMILESCOc1ccc(C)cc1C(C)(NCCN(C)C)C(N)=O
InChIInChI=1S/C15H25N3O2/c1-11-6-7-13(20-5)12(10-11)15(2,14(16)19)17-8-9-18(3)4/h6-7,10,17H,8-9H2,1-5H3,(H2,16,19)
InChIKeyFGHMBWYDYKYVSJ-UHFFFAOYSA-N
MW279.38 g/mol
LogP0.86
Rot. Bonds7

About 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide

2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide (PubChem CID 60992003) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide
PubChem CID60992003
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide
SMILESCOc1ccc(C)cc1C(C)(NCCN(C)C)C(N)=O
InChIInChI=1S/C15H25N3O2/c1-11-6-7-13(20-5)12(10-11)15(2,14(16)19)17-8-9-18(3)4/h6-7,10,17H,8-9H2,1-5H3,(H2,16,19)
InChIKeyFGHMBWYDYKYVSJ-UHFFFAOYSA-N
XLogP0.86
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[2-(dimethylamino)ethylamino]-2-(2,5-dimethylphenyl)propanoate
CID 61002169
2-[2-(diethylamino)ethylamino]-2-(2,5-dimethylphenyl)propanamide
CID 60995327
methyl 2-[2-(dimethylamino)ethylamino]-2-(2,4-dimethylphenyl)propanoate
CID 61002978
2-[2-(dimethylamino)ethylamino]-2-(2,4,6-trimethylphenyl)propanamide
CID 60991164
2-(2,4-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 54891609
2-[2-(diethylamino)ethylamino]-2-(2-methoxyphenyl)propanamide
CID 60995329
2-(cyclohexylamino)-2-(2-methoxy-5-methylphenyl)propanamide
CID 60998168
2-[2-(dimethylamino)ethylamino]-2-(3-methoxyphenyl)propanamide
CID 54891175
2-(ethylamino)-2-(2-methoxy-5-methylphenyl)propanoic acid
CID 43753817
2-(2-methoxy-5-methylphenyl)-2-(prop-2-enylamino)propanoic acid
CID 61341396
N-[2-(dimethylamino)ethyl]-2-methoxy-5-methylbenzamide
CID 110761060
methyl 2-(2-methoxy-5-methylphenyl)-2-(prop-2-ynylamino)propanoate
CID 55062919

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide?
The IUPAC name of 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide (CID 60992003) is 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide?
The canonical SMILES for 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide is COc1ccc(C)cc1C(C)(NCCN(C)C)C(N)=O.
What is the InChIKey of 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide?
The InChIKey is FGHMBWYDYKYVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11-6-7-13(20-5)12(10-11)15(2,14(16)19)17-8-9-18(3)4/h6-7,10,17H,8-9H2,1-5H3,(H2,16,19).
What are the key properties of 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide?
2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide has a molecular weight of 279.38 g/mol, XLogP of 0.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethylamino]-2-(2-methoxy-5-methylphenyl)propanamide is sourced from PubChem (CID 60992003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).