2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine

C11H20N4 — CID 107500731

IUPAC2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine
SMILESCC1CCN(Cc2cn(CCN)cn2)C1
InChIInChI=1S/C11H20N4/c1-10-2-4-14(6-10)7-11-8-15(5-3-12)9-13-11/h8-10H,2-7,12H2,1H3
InChIKeyQERPWZZPLANNPL-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.68
Rot. Bonds4

About 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine

2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine (PubChem CID 107500731) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine
PubChem CID107500731
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine
SMILESCC1CCN(Cc2cn(CCN)cn2)C1
InChIInChI=1S/C11H20N4/c1-10-2-4-14(6-10)7-11-8-15(5-3-12)9-13-11/h8-10H,2-7,12H2,1H3
InChIKeyQERPWZZPLANNPL-UHFFFAOYSA-N
XLogP0.68
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-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

Related Compounds

2-[4-[(4,4-dimethylpiperidin-1-yl)methyl]imidazol-1-yl]ethanamine
CID 107500889
2-[4-[(4-ethylpiperazin-1-yl)methyl]imidazol-1-yl]ethanamine
CID 107500649
2-[4-[(2-ethylmorpholin-4-yl)methyl]imidazol-1-yl]ethanamine
CID 107500684
2-[4-[(2,4-dimethylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine
CID 107501201
N-[[1-(2-aminoethyl)imidazol-4-yl]methyl]-3-methylcyclopentan-1-amine
CID 107501214
[1-(2-piperidin-1-ylethyl)imidazol-4-yl]methanamine
CID 106718060
N-[[1-(2-aminoethyl)imidazol-4-yl]methyl]-N-methylcyclobutanamine
CID 107501185
1-[(1-ethylimidazol-4-yl)methyl]piperidine
CID 117191782
N-[[1-(2-aminoethyl)imidazol-4-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 107500803
N-[[1-(2-aminoethyl)imidazol-4-yl]methyl]-N-prop-2-enylcyclopropanamine
CID 107501127
[1-[2-(1-methylpiperidin-2-yl)ethyl]imidazol-4-yl]methanamine
CID 107913121
[3-[(3-methylpyrrolidin-1-yl)methyl]phenyl]methanamine
CID 61224005

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine?
The IUPAC name of 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine (CID 107500731) is 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine.
What is the SMILES notation for 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine?
The canonical SMILES for 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine is CC1CCN(Cc2cn(CCN)cn2)C1.
What is the InChIKey of 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine?
The InChIKey is QERPWZZPLANNPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-10-2-4-14(6-10)7-11-8-15(5-3-12)9-13-11/h8-10H,2-7,12H2,1H3.
What are the key properties of 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine?
2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine has a molecular weight of 208.31 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3-methylpyrrolidin-1-yl)methyl]imidazol-1-yl]ethanamine is sourced from PubChem (CID 107500731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).