3-(2-methoxyimidazol-1-yl)propan-1-amine

C7H13N3O — CID 82416306

IUPAC3-(2-methoxyimidazol-1-yl)propan-1-amine
SMILESCOc1nccn1CCCN
InChIInChI=1S/C7H13N3O/c1-11-7-9-4-6-10(7)5-2-3-8/h4,6H,2-3,5,8H2,1H3
InChIKeyMXLODUDUOHFMIW-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.24
Rot. Bonds4

About 3-(2-methoxyimidazol-1-yl)propan-1-amine

3-(2-methoxyimidazol-1-yl)propan-1-amine (PubChem CID 82416306) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-(2-methoxyimidazol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyimidazol-1-yl)propan-1-amine
PubChem CID82416306
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name3-(2-methoxyimidazol-1-yl)propan-1-amine
SMILESCOc1nccn1CCCN
InChIInChI=1S/C7H13N3O/c1-11-7-9-4-6-10(7)5-2-3-8/h4,6H,2-3,5,8H2,1H3
InChIKeyMXLODUDUOHFMIW-UHFFFAOYSA-N
XLogP0.24
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-methoxyimidazol-1-yl)propan-1-amine 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-(2-propan-2-ylimidazol-1-yl)propan-1-amine;dihydrobromide
CID 17139034
3-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]propan-1-amine
CID 82557807
3-[2-(2-fluorophenyl)imidazol-1-yl]propan-1-amine
CID 82559058
3-[2-(3,5-difluorophenyl)imidazol-1-yl]propan-1-amine
CID 82559838
N'-(1-ethylimidazol-2-yl)-N'-methylpentane-1,5-diamine
CID 107206923
4-(1-methylimidazol-2-yl)butan-1-amine
CID 79762041
4-[1-(4-aminobutyl)imidazol-2-yl]-N,N-dimethylaniline
CID 82559228
3-(1-butylimidazol-2-yl)propan-1-amine;methyl hydrogen sulfate
CID 173027773
3-[2-(2-phenylethyl)imidazol-1-yl]propan-1-amine
CID 57082680
3-(2-methylimidazol-1-yl)propan-1-amine;quinoline
CID 174881981
2-[1-(2-methoxyethyl)imidazol-2-yl]ethanamine
CID 62410004
3-[1-(3-aminopropyl)imidazol-2-yl]-7-methoxy-1H-quinolin-2-one;dihydrochloride
CID 154922122

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyimidazol-1-yl)propan-1-amine?
The IUPAC name of 3-(2-methoxyimidazol-1-yl)propan-1-amine (CID 82416306) is 3-(2-methoxyimidazol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(2-methoxyimidazol-1-yl)propan-1-amine?
The canonical SMILES for 3-(2-methoxyimidazol-1-yl)propan-1-amine is COc1nccn1CCCN.
What is the InChIKey of 3-(2-methoxyimidazol-1-yl)propan-1-amine?
The InChIKey is MXLODUDUOHFMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-11-7-9-4-6-10(7)5-2-3-8/h4,6H,2-3,5,8H2,1H3.
What are the key properties of 3-(2-methoxyimidazol-1-yl)propan-1-amine?
3-(2-methoxyimidazol-1-yl)propan-1-amine has a molecular weight of 155.20 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyimidazol-1-yl)propan-1-amine is sourced from PubChem (CID 82416306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).