N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine

C11H16N4O — CID 102673231

IUPACN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine
SMILESCc1nc(CNCc2cncn2C)oc1C
InChIInChI=1S/C11H16N4O/c1-8-9(2)16-11(14-8)6-12-4-10-5-13-7-15(10)3/h5,7,12H,4,6H2,1-3H3
InChIKeyGFEFGBNOPSMLPG-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.31
Rot. Bonds4

About N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine (PubChem CID 102673231) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine.

Molecular Properties

Compound NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine
PubChem CID102673231
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine
SMILESCc1nc(CNCc2cncn2C)oc1C
InChIInChI=1S/C11H16N4O/c1-8-9(2)16-11(14-8)6-12-4-10-5-13-7-15(10)3/h5,7,12H,4,6H2,1-3H3
InChIKeyGFEFGBNOPSMLPG-UHFFFAOYSA-N
XLogP1.31
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-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-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-propylimidazol-4-yl)methanamine
CID 114180159
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(2,5-dimethylpyrazol-3-yl)methanamine
CID 114180444
1-(3-methylimidazol-4-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine
CID 62998460
N-[(3-methylimidazol-4-yl)methyl]-1-(2-methylpyrimidin-4-yl)methanamine
CID 63002010
N-[(3-methylimidazol-4-yl)methyl]-1-thiophen-2-ylmethanamine
CID 62999179
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-pyrazolo[1,5-a]pyridin-3-ylmethanamine
CID 102673132
1-(1-tert-butylpyrazol-4-yl)-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]methanamine
CID 102673286
1-(3-methylimidazol-4-yl)-N-[(1-methylimidazol-2-yl)methyl]methanamine
CID 63237108
2-[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]acetonitrile
CID 106372653
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106374088
2-[3-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]imidazol-4-yl]ethanamine
CID 106377565
4-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]-2,6-dimethylphenol
CID 106370332

Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine?
The IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine (CID 102673231) is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine.
What is the SMILES notation for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine?
The canonical SMILES for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine is Cc1nc(CNCc2cncn2C)oc1C.
What is the InChIKey of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine?
The InChIKey is GFEFGBNOPSMLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-8-9(2)16-11(14-8)6-12-4-10-5-13-7-15(10)3/h5,7,12H,4,6H2,1-3H3.
What are the key properties of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine?
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine has a molecular weight of 220.28 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylimidazol-4-yl)methanamine is sourced from PubChem (CID 102673231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).