N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine

C12H16N4 — CID 106718523

IUPACN-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine
SMILESCNCc1cn(Cc2cncc(C)c2)cn1
InChIInChI=1S/C12H16N4/c1-10-3-11(5-14-4-10)7-16-8-12(6-13-2)15-9-16/h3-5,8-9,13H,6-7H2,1-2H3
InChIKeyLIFYJLQXXAATOK-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.35
Rot. Bonds4

About N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine

N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine (PubChem CID 106718523) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine
PubChem CID106718523
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC NameN-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine
SMILESCNCc1cn(Cc2cncc(C)c2)cn1
InChIInChI=1S/C12H16N4/c1-10-3-11(5-14-4-10)7-16-8-12(6-13-2)15-9-16/h3-5,8-9,13H,6-7H2,1-2H3
InChIKeyLIFYJLQXXAATOK-UHFFFAOYSA-N
XLogP1.35
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine 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-[[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methyl]ethanamine
CID 106718891
N-[[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 106719982
N-methyl-1-[1-[(3-methylphenyl)methyl]imidazol-4-yl]methanamine
CID 83886789
1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-amine
CID 165473180
2-[1-[(5-bromo-3-pyridinyl)methyl]imidazol-4-yl]-N-methylethanamine
CID 113455792
N-[[1-[(5-bromo-3-pyridinyl)methyl]imidazol-4-yl]methyl]ethanamine
CID 106718876
1-[1-[(4-methoxyphenyl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 83894862
1-[1-[(3-bromo-4-methoxyphenyl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 106718473
1-[1-[(3-cyclopropylimidazol-4-yl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 106718324
1-[1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 106718437
N-methyl-2-[1-[(4-methylphenyl)methyl]imidazol-4-yl]ethanamine
CID 79985488
N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]indol-4-yl]methanamine
CID 102877971

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine?
The IUPAC name of N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine (CID 106718523) is N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine is CNCc1cn(Cc2cncc(C)c2)cn1.
What is the InChIKey of N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine?
The InChIKey is LIFYJLQXXAATOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-10-3-11(5-14-4-10)7-16-8-12(6-13-2)15-9-16/h3-5,8-9,13H,6-7H2,1-2H3.
What are the key properties of N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine?
N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine has a molecular weight of 216.29 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine is sourced from PubChem (CID 106718523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).