2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide

C12H22N4O — CID 84592025

IUPAC2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide
SMILESCC(C(=O)N(C)C)N(C)CCCn1ccnc1
InChIInChI=1S/C12H22N4O/c1-11(12(17)14(2)3)15(4)7-5-8-16-9-6-13-10-16/h6,9-11H,5,7-8H2,1-4H3
InChIKeyUCIMMQLKNTYOKF-UHFFFAOYSA-N
MW238.34 g/mol
LogP0.68
Rot. Bonds6

About 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide

2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide (PubChem CID 84592025) has the molecular formula C12H22N4O and a molecular weight of 238.34 g/mol. Its IUPAC name is 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide
PubChem CID84592025
Molecular FormulaC12H22N4O
Molecular Weight238.34 g/mol
Exact Mass238.18
IUPAC Name2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide
SMILESCC(C(=O)N(C)C)N(C)CCCn1ccnc1
InChIInChI=1S/C12H22N4O/c1-11(12(17)14(2)3)15(4)7-5-8-16-9-6-13-10-16/h6,9-11H,5,7-8H2,1-4H3
InChIKeyUCIMMQLKNTYOKF-UHFFFAOYSA-N
XLogP0.68
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-imidazol-1-ylpropyl(methyl)amino]propan-2-ol
CID 62334128
3-[3-imidazol-1-ylpropyl(methyl)amino]propanoic acid
CID 61492835
(2R)-2-[3-imidazol-1-ylpropyl(methyl)amino]-N-(4-morpholin-4-ylphenyl)propanamide
CID 97236237
2-[3-imidazol-1-ylpropyl(2-methylpropyl)amino]acetic acid
CID 63065726
N-[(1S)-1-(3-chlorophenyl)ethyl]-3-imidazol-1-yl-N-methylpropan-1-amine
CID 97020997
1-(7-methyloctyl)imidazole
CID 59001100
1-(14-imidazol-1-yltetradecyl)imidazole;hydrochloride
CID 57391442
N-(3-bromopropyl)-3-imidazol-1-yl-N-propan-2-ylpropan-1-amine
CID 80679358
3-[acetyl(3-imidazol-1-ylpropyl)amino]propanoic acid
CID 82323160
carbonic acid;1-dodecylimidazole
CID 175596781
2-bromo-N-(3-imidazol-1-ylpropyl)-N-methylprop-2-en-1-amine
CID 75435415
1-[3-[[methyl(propan-2-yl)sulfamoyl]amino]propyl]imidazole
CID 56812922

Frequently Asked Questions

What is the IUPAC name of 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide (CID 84592025) is 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide is CC(C(=O)N(C)C)N(C)CCCn1ccnc1.
What is the InChIKey of 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide?
The InChIKey is UCIMMQLKNTYOKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-11(12(17)14(2)3)15(4)7-5-8-16-9-6-13-10-16/h6,9-11H,5,7-8H2,1-4H3.
What are the key properties of 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide?
2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide has a molecular weight of 238.34 g/mol, XLogP of 0.68, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-imidazol-1-ylpropyl(methyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 84592025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).