1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine

C14H23N5 — CID 101273220

IUPAC1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine
SMILESCCc1nc(CNCc2nc(CC)[nH]c2C)c(C)[nH]1
InChIInChI=1S/C14H23N5/c1-5-13-16-9(3)11(18-13)7-15-8-12-10(4)17-14(6-2)19-12/h15H,5-8H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyOHIBIFPJMXLKJO-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.16
Rot. Bonds6

About 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine

1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine (PubChem CID 101273220) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine
PubChem CID101273220
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine
SMILESCCc1nc(CNCc2nc(CC)[nH]c2C)c(C)[nH]1
InChIInChI=1S/C14H23N5/c1-5-13-16-9(3)11(18-13)7-15-8-12-10(4)17-14(6-2)19-12/h15H,5-8H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyOHIBIFPJMXLKJO-UHFFFAOYSA-N
XLogP2.16
TPSA69.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine?
The IUPAC name of 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine (CID 101273220) is 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine?
The canonical SMILES for 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine is CCc1nc(CNCc2nc(CC)[nH]c2C)c(C)[nH]1.
What is the InChIKey of 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine?
The InChIKey is OHIBIFPJMXLKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-5-13-16-9(3)11(18-13)7-15-8-12-10(4)17-14(6-2)19-12/h15H,5-8H2,1-4H3,(H,16,18)(H,17,19).
What are the key properties of 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine?
1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine has a molecular weight of 261.37 g/mol, XLogP of 2.16, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-5-methyl-1H-imidazol-4-yl)-N-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]methanamine is sourced from PubChem (CID 101273220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).