[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium

C11H16N3+ — CID 7008225

IUPAC[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium
SMILESCC(C)[C@@H]([NH3+])c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3/c1-7(2)10(12)11-13-8-5-3-4-6-9(8)14-11/h3-7,10H,12H2,1-2H3,(H,13,14)/p+1/t10-/m1/s1
InChIKeyJDPVJORLNSVLOK-SNVBAGLBSA-O
MW190.27 g/mol
LogP1.50
Rot. Bonds2

About [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium

[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium (PubChem CID 7008225) has the molecular formula C11H16N3+ and a molecular weight of 190.27 g/mol. Its IUPAC name is [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium.

Molecular Properties

Compound Name[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium
PubChem CID7008225
Molecular FormulaC11H16N3+
Molecular Weight190.27 g/mol
Exact Mass190.13
IUPAC Name[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium
SMILESCC(C)[C@@H]([NH3+])c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3/c1-7(2)10(12)11-13-8-5-3-4-6-9(8)14-11/h3-7,10H,12H2,1-2H3,(H,13,14)/p+1/t10-/m1/s1
InChIKeyJDPVJORLNSVLOK-SNVBAGLBSA-O
XLogP1.50
TPSA56.32 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium 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-propan-2-yl-1H-benzimidazole
CID 22121
(1S)-1-(1H-benzimidazol-2-yl)ethanol
CID 139074850
(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropan-1-amine;dihydrochloride
CID 112756298
2-(2-methyl-1-phenylpropyl)-1H-benzimidazole
CID 146180752
[(1S)-1-(1H-benzimidazol-2-yl)propyl]azanium
CID 6955866
bis(1H-benzimidazol-2-yl)methanol
CID 3747179
2-propan-2-yl-4-tritio-1H-benzimidazole
CID 155790208
1,3-bis(1H-benzimidazol-2-yl)propane-1,2,3-triol
CID 2772761
4-[1-(1H-benzimidazol-2-yl)ethyl]-1,2,4-triazolidine-3,5-dione
CID 107409781
[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]azanium
CID 7008937
2-(1-ethoxypropan-2-yl)-1H-benzimidazole
CID 20681263
[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]azanium
CID 7008936

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium?
The IUPAC name of [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium (CID 7008225) is [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium.
What is the SMILES notation for [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium?
The canonical SMILES for [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium is CC(C)[C@@H]([NH3+])c1nc2ccccc2[nH]1.
What is the InChIKey of [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium?
The InChIKey is JDPVJORLNSVLOK-SNVBAGLBSA-O. The full InChI is InChI=1S/C11H15N3/c1-7(2)10(12)11-13-8-5-3-4-6-9(8)14-11/h3-7,10H,12H2,1-2H3,(H,13,14)/p+1/t10-/m1/s1.
What are the key properties of [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium?
[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium has a molecular weight of 190.27 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium is sourced from PubChem (CID 7008225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).