3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide

C10H18N4O — CID 66150956

IUPAC3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCn1cncc1CN
InChIInChI=1S/C10H18N4O/c1-2-4-13-10(15)3-5-14-8-12-7-9(14)6-11/h7-8H,2-6,11H2,1H3,(H,13,15)
InChIKeyZAHSLOLBZVGBEG-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.26
Rot. Bonds6

About 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide

3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide (PubChem CID 66150956) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide.

Molecular Properties

Compound Name3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide
PubChem CID66150956
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCn1cncc1CN
InChIInChI=1S/C10H18N4O/c1-2-4-13-10(15)3-5-14-8-12-7-9(14)6-11/h7-8H,2-6,11H2,1H3,(H,13,15)
InChIKeyZAHSLOLBZVGBEG-UHFFFAOYSA-N
XLogP0.26
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide 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

3-[5-(hydroxymethyl)imidazol-1-yl]-N-propylpropanamide
CID 66150619
N-propyl-3-[5-(propylaminomethyl)imidazol-1-yl]propanamide
CID 66150955
3-[(3-ethylimidazol-4-yl)methylamino]-N-propylpropanamide
CID 66135289
3-[5-(6-amino-3-pyridinyl)imidazol-1-yl]-N-propylpropanamide
CID 114719410
3-[5-(4-methylpiperidin-4-yl)imidazol-1-yl]-N-propylpropanamide
CID 114719413
N-cyclopropyl-3-[5-(propylaminomethyl)imidazol-1-yl]propanamide
CID 79401326
3-[5-(hydroxymethyl)imidazol-1-yl]-N-methylpropanamide
CID 66150409
3-[5-(chloromethyl)imidazol-1-yl]-N-methylpropanamide
CID 66150216
2-[5-(aminomethyl)imidazol-1-yl]-N-propan-2-ylacetamide
CID 66146106
3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]-N-ethylpropanamide
CID 102969836
[3-[(E)-pent-3-enyl]imidazol-4-yl]methanamine
CID 114707540
(2S)-2-amino-3-(3-propylimidazol-4-yl)propanoic acid
CID 54225588

Frequently Asked Questions

What is the IUPAC name of 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide?
The IUPAC name of 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide (CID 66150956) is 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide.
What is the SMILES notation for 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide?
The canonical SMILES for 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide is CCCNC(=O)CCn1cncc1CN.
What is the InChIKey of 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide?
The InChIKey is ZAHSLOLBZVGBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-2-4-13-10(15)3-5-14-8-12-7-9(14)6-11/h7-8H,2-6,11H2,1H3,(H,13,15).
What are the key properties of 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide?
3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide has a molecular weight of 210.28 g/mol, XLogP of 0.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(aminomethyl)imidazol-1-yl]-N-propylpropanamide is sourced from PubChem (CID 66150956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).