N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride

C11H15Cl2N3 — CID 72716194

IUPACN-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
SMILESCNCc1ncc(-c2ccccc2)[nH]1.Cl.Cl
InChIInChI=1S/C11H13N3.2ClH/c1-12-8-11-13-7-10(14-11)9-5-3-2-4-6-9;;/h2-7,12H,8H2,1H3,(H,13,14);2*1H
InChIKeyHRMITNVPSOPSJJ-UHFFFAOYSA-N
MW260.17 g/mol
LogP2.64
Rot. Bonds3

About N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride

N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride (PubChem CID 72716194) has the molecular formula C11H15Cl2N3 and a molecular weight of 260.17 g/mol. Its IUPAC name is N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride.

Molecular Properties

Compound NameN-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
PubChem CID72716194
Molecular FormulaC11H15Cl2N3
Molecular Weight260.17 g/mol
Exact Mass259.06
IUPAC NameN-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride
SMILESCNCc1ncc(-c2ccccc2)[nH]1.Cl.Cl
InChIInChI=1S/C11H13N3.2ClH/c1-12-8-11-13-7-10(14-11)9-5-3-2-4-6-9;;/h2-7,12H,8H2,1H3,(H,13,14);2*1H
InChIKeyHRMITNVPSOPSJJ-UHFFFAOYSA-N
XLogP2.64
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride 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-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-N-methylmethanamine;dihydrochloride
CID 72716184
2-(chloromethyl)-5-phenyl-1H-imidazole;hydrochloride
CID 139644021
2-(5-phenyl-1H-imidazol-2-yl)ethanamine;dihydrochloride
CID 13170817
1-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 43651401
1-(5-phenyl-1H-imidazol-2-yl)propan-2-amine
CID 60840875
N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
CID 60852746
1-[5-(4-cyclohexylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 82305684
[5-(4-phenylphenyl)-1H-imidazol-2-yl]methanethiol
CID 116879175
N-methyl-1-[5-(10H-phenothiazin-2-yl)-1H-imidazol-2-yl]methanamine;hydrochloride
CID 67214155
N-methyl-1-(5-methyl-1H-imidazol-2-yl)methanamine;dihydrochloride
CID 53398821
5-phenyl-N-[(5-phenyl-1H-imidazol-2-yl)methyl]-1,2,4-oxadiazol-3-amine
CID 133482502
N-methyl-2-(methylamino)-N-[(5-phenyl-1H-imidazol-2-yl)methyl]acetamide
CID 120705058

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride?
The IUPAC name of N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride (CID 72716194) is N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride.
What is the SMILES notation for N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride?
The canonical SMILES for N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride is CNCc1ncc(-c2ccccc2)[nH]1.Cl.Cl.
What is the InChIKey of N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride?
The InChIKey is HRMITNVPSOPSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3.2ClH/c1-12-8-11-13-7-10(14-11)9-5-3-2-4-6-9;;/h2-7,12H,8H2,1H3,(H,13,14);2*1H.
What are the key properties of N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride?
N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride has a molecular weight of 260.17 g/mol, XLogP of 2.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-phenyl-1H-imidazol-2-yl)methanamine;dihydrochloride is sourced from PubChem (CID 72716194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).