N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine

C10H15N5 — CID 62132911

IUPACN-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine
SMILESCn1ccnc1NCCCn1ccnc1
InChIInChI=1S/C10H15N5/c1-14-7-5-13-10(14)12-3-2-6-15-8-4-11-9-15/h4-5,7-9H,2-3,6H2,1H3,(H,12,13)
InChIKeyFWKCRYBGOXKLQO-UHFFFAOYSA-N
MW205.27 g/mol
LogP1.12
Rot. Bonds5

About N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine

N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine (PubChem CID 62132911) has the molecular formula C10H15N5 and a molecular weight of 205.27 g/mol. Its IUPAC name is N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine
PubChem CID62132911
Molecular FormulaC10H15N5
Molecular Weight205.27 g/mol
Exact Mass205.13
IUPAC NameN-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine
SMILESCn1ccnc1NCCCn1ccnc1
InChIInChI=1S/C10H15N5/c1-14-7-5-13-10(14)12-3-2-6-15-8-4-11-9-15/h4-5,7-9H,2-3,6H2,1H3,(H,12,13)
InChIKeyFWKCRYBGOXKLQO-UHFFFAOYSA-N
XLogP1.12
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-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

N-(4-imidazol-1-ylbutyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106565958
1-tert-butyl-3-(3-imidazol-1-ylpropylamino)pyrazin-2-one
CID 62938441
5-bromo-N-(3-imidazol-1-ylpropyl)-1,3,4-thiadiazol-2-amine
CID 64623662
N-(3-imidazol-1-ylpropyl)-1-methylpyrazol-3-amine
CID 79778766
4-N,6-N-bis(3-imidazol-1-ylpropyl)pyrimidine-4,5,6-triamine
CID 19154189
N-(3-imidazol-1-ylpropyl)-4-methylpyrimidin-2-amine
CID 62960707
5-chloro-4-N-(3-imidazol-1-ylpropyl)-2-N-methylpyrimidine-2,4-diamine
CID 80753932
2,3,4,5,6-pentafluoro-N-(3-imidazol-1-ylpropyl)aniline
CID 28826187
N-(3-imidazol-1-ylpropyl)pyrimidin-5-amine
CID 82539235
N-(3-imidazol-1-ylpropyl)-6-methylpyrimidin-4-amine
CID 61225498
4-N-(3-imidazol-1-ylpropyl)-6-N,2-dimethylpyrimidine-4,6-diamine
CID 80753606
6-N-ethyl-4-N-(3-imidazol-1-ylpropyl)pyrimidine-4,6-diamine
CID 80753525

Frequently Asked Questions

What is the IUPAC name of N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine?
The IUPAC name of N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine (CID 62132911) is N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine.
What is the SMILES notation for N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine?
The canonical SMILES for N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine is Cn1ccnc1NCCCn1ccnc1.
What is the InChIKey of N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine?
The InChIKey is FWKCRYBGOXKLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-14-7-5-13-10(14)12-3-2-6-15-8-4-11-9-15/h4-5,7-9H,2-3,6H2,1H3,(H,12,13).
What are the key properties of N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine?
N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine has a molecular weight of 205.27 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-imidazol-1-ylpropyl)-1-methylimidazol-2-amine is sourced from PubChem (CID 62132911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).