(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine

C10H17N3 — CID 104943894

IUPAC(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine
SMILESCC1CC(n2cncc2[C@@H](C)N)C1
InChIInChI=1S/C10H17N3/c1-7-3-9(4-7)13-6-12-5-10(13)8(2)11/h5-9H,3-4,11H2,1-2H3/t7?,8-,9?/m1/s1
InChIKeyOUSVRFYMJROPMS-QJAFJHJLSA-N
MW179.27 g/mol
LogP1.87
Rot. Bonds2

About (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine

(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine (PubChem CID 104943894) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine
PubChem CID104943894
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine
SMILESCC1CC(n2cncc2[C@@H](C)N)C1
InChIInChI=1S/C10H17N3/c1-7-3-9(4-7)13-6-12-5-10(13)8(2)11/h5-9H,3-4,11H2,1-2H3/t7?,8-,9?/m1/s1
InChIKeyOUSVRFYMJROPMS-QJAFJHJLSA-N
XLogP1.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine?
The IUPAC name of (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine (CID 104943894) is (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine?
The canonical SMILES for (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine is CC1CC(n2cncc2[C@@H](C)N)C1.
What is the InChIKey of (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine?
The InChIKey is OUSVRFYMJROPMS-QJAFJHJLSA-N. The full InChI is InChI=1S/C10H17N3/c1-7-3-9(4-7)13-6-12-5-10(13)8(2)11/h5-9H,3-4,11H2,1-2H3/t7?,8-,9?/m1/s1.
What are the key properties of (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine?
(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine has a molecular weight of 179.27 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 104943894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).