3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide

C10H18N4O — CID 102969533

IUPAC3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide
SMILESCC(C)C(N)c1cncn1CCC(N)=O
InChIInChI=1S/C10H18N4O/c1-7(2)10(12)8-5-13-6-14(8)4-3-9(11)15/h5-7,10H,3-4,12H2,1-2H3,(H2,11,15)
InChIKeyDHLKBQZRFDGOMQ-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.41
Rot. Bonds5

About 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide

3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide (PubChem CID 102969533) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide.

Molecular Properties

Compound Name3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide
PubChem CID102969533
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide
SMILESCC(C)C(N)c1cncn1CCC(N)=O
InChIInChI=1S/C10H18N4O/c1-7(2)10(12)8-5-13-6-14(8)4-3-9(11)15/h5-7,10H,3-4,12H2,1-2H3,(H2,11,15)
InChIKeyDHLKBQZRFDGOMQ-UHFFFAOYSA-N
XLogP0.41
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide 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-(1-amino-2-methylpropyl)imidazol-1-yl]-N-ethylpropanamide
CID 102969836
1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine
CID 102969486
2-methyl-1-[3-(2-methylsulfanylethyl)imidazol-4-yl]propan-1-amine
CID 102969725
2-methyl-1-[3-(5-methylsulfanylpentyl)imidazol-4-yl]propan-1-amine
CID 114128184
3-(5-propan-2-ylimidazol-1-yl)propanoic acid
CID 82512164
1-[3-(2-ethylbutyl)imidazol-4-yl]-2-methylpropan-1-amine
CID 102969891
3-[5-[(1R)-1-aminoethyl]imidazol-1-yl]-N,N-dimethylpropanamide
CID 104942518
2-methyl-1-[3-(2-thiomorpholin-4-ylethyl)imidazol-4-yl]propan-1-amine
CID 114174001
2-methyl-1-[3-[2-(4-nitrophenyl)ethyl]imidazol-4-yl]propan-1-amine
CID 102969562
(1S)-1-[3-(2-aminoethyl)imidazol-4-yl]ethanamine
CID 104942319
3-[5-(1-amino-3-methylbutyl)imidazol-1-yl]-N-methylpropanamide
CID 114705066
3-[5-[(1S)-1-aminoethyl]imidazol-1-yl]-N-butan-2-ylpropanamide
CID 104942629

Frequently Asked Questions

What is the IUPAC name of 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide?
The IUPAC name of 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide (CID 102969533) is 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide.
What is the SMILES notation for 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide?
The canonical SMILES for 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide is CC(C)C(N)c1cncn1CCC(N)=O.
What is the InChIKey of 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide?
The InChIKey is DHLKBQZRFDGOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7(2)10(12)8-5-13-6-14(8)4-3-9(11)15/h5-7,10H,3-4,12H2,1-2H3,(H2,11,15).
What are the key properties of 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide?
3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide is sourced from PubChem (CID 102969533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).