1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine

C9H17N5 — CID 117187169

IUPAC1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine
SMILESCn1cc(N)nc1CN1CCNCC1
InChIInChI=1S/C9H17N5/c1-13-6-8(10)12-9(13)7-14-4-2-11-3-5-14/h6,11H,2-5,7,10H2,1H3
InChIKeyWTDQEHOWISAZHH-UHFFFAOYSA-N
MW195.27 g/mol
LogP-0.59
Rot. Bonds2

About 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine

1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine (PubChem CID 117187169) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine.

Molecular Properties

Compound Name1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine
PubChem CID117187169
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine
SMILESCn1cc(N)nc1CN1CCNCC1
InChIInChI=1S/C9H17N5/c1-13-6-8(10)12-9(13)7-14-4-2-11-3-5-14/h6,11H,2-5,7,10H2,1H3
InChIKeyWTDQEHOWISAZHH-UHFFFAOYSA-N
XLogP-0.59
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-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

1-methyl-2-(pyrrolidin-1-ylmethyl)imidazol-4-amine
CID 117187142
1-[(5-bromo-1-methylimidazol-2-yl)methyl]piperazine
CID 117188331
1-methyl-2-(1,4,7-triazonan-1-ylmethyl)benzimidazole
CID 70105474
4-methyl-6-(piperazin-1-ylmethyl)pyrimidin-2-amine
CID 82507434
5-(piperazin-1-ylmethyl)pyrazin-2-amine
CID 117213222
1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 65215067
1-methyl-3-(piperazin-1-ylmethyl)indol-5-amine
CID 117174991
2-(piperazin-1-ylmethyl)-1-propan-2-ylimidazole-4-carboxylic acid
CID 117187557
1-[(4-bromo-1-methylpyrazol-3-yl)methyl]piperazine
CID 83901819
7-bromo-1,5-dimethyl-2-(piperazin-1-ylmethyl)benzimidazole
CID 84646092
5,6-dimethyl-3-(piperazin-1-ylmethyl)-1,2,4-triazine
CID 82470457
1-[(1-methylpyrrol-3-yl)methyl]piperazine
CID 82280746

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine?
The IUPAC name of 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine (CID 117187169) is 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine.
What is the SMILES notation for 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine?
The canonical SMILES for 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine is Cn1cc(N)nc1CN1CCNCC1.
What is the InChIKey of 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine?
The InChIKey is WTDQEHOWISAZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-13-6-8(10)12-9(13)7-14-4-2-11-3-5-14/h6,11H,2-5,7,10H2,1H3.
What are the key properties of 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine?
1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine has a molecular weight of 195.27 g/mol, XLogP of -0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(piperazin-1-ylmethyl)imidazol-4-amine is sourced from PubChem (CID 117187169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).