2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide

C15H26N4O — CID 60995360

IUPAC2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide
SMILESCN(C)CCNC(C)(C(N)=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C15H26N4O/c1-15(14(16)20,17-10-11-18(2)3)12-6-8-13(9-7-12)19(4)5/h6-9,17H,10-11H2,1-5H3,(H2,16,20)
InChIKeyZWZYRVDVIYOUJP-UHFFFAOYSA-N
MW278.40 g/mol
LogP0.60
Rot. Bonds7

About 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide

2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide (PubChem CID 60995360) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide
PubChem CID60995360
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide
SMILESCN(C)CCNC(C)(C(N)=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C15H26N4O/c1-15(14(16)20,17-10-11-18(2)3)12-6-8-13(9-7-12)19(4)5/h6-9,17H,10-11H2,1-5H3,(H2,16,20)
InChIKeyZWZYRVDVIYOUJP-UHFFFAOYSA-N
XLogP0.60
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

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Related Compounds

2-(4-bromophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 54891318
2-[2-(dimethylamino)ethylamino]-2-(4-ethoxyphenyl)propanamide
CID 60991163
2-(3-chloro-4-fluorophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 54891418
2-[2-(dimethylamino)ethylamino]-2-(3-methoxyphenyl)propanamide
CID 54891175
2-[4-(dimethylamino)phenyl]-2-(propylamino)propanoic acid
CID 54880652
2-anilino-2-[4-(dimethylamino)phenyl]propanamide
CID 61004832
2-(5-bromofuran-2-yl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 104653361
2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide
CID 60995324
2-[2-(dimethylamino)ethylamino]-2-(2,4,6-trimethylphenyl)propanamide
CID 60991164
ethyl 2-[2-(dimethylamino)ethylamino]-2-(4-hydroxyphenyl)propanoate
CID 61001287
2-(2,4-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 54891609
2-(5-bromo-2-fluorophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 82967482

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide?
The IUPAC name of 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide (CID 60995360) is 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide?
The canonical SMILES for 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide is CN(C)CCNC(C)(C(N)=O)c1ccc(N(C)C)cc1.
What is the InChIKey of 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide?
The InChIKey is ZWZYRVDVIYOUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-15(14(16)20,17-10-11-18(2)3)12-6-8-13(9-7-12)19(4)5/h6-9,17H,10-11H2,1-5H3,(H2,16,20).
What are the key properties of 2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide?
2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide has a molecular weight of 278.40 g/mol, XLogP of 0.60, 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-[4-(dimethylamino)phenyl]propanamide is sourced from PubChem (CID 60995360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).