N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine

C12H18N6O — CID 79738564

IUPACN-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCNc1nc(Cc2nccn2C)nc(OC(C)C)n1
InChIInChI=1S/C12H18N6O/c1-8(2)19-12-16-9(15-11(13-3)17-12)7-10-14-5-6-18(10)4/h5-6,8H,7H2,1-4H3,(H,13,15,16,17)
InChIKeyTXQWPJUCOJSYOM-UHFFFAOYSA-N
MW262.32 g/mol
LogP1.02
Rot. Bonds5

About N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine

N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 79738564) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID79738564
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC NameN-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCNc1nc(Cc2nccn2C)nc(OC(C)C)n1
InChIInChI=1S/C12H18N6O/c1-8(2)19-12-16-9(15-11(13-3)17-12)7-10-14-5-6-18(10)4/h5-6,8H,7H2,1-4H3,(H,13,15,16,17)
InChIKeyTXQWPJUCOJSYOM-UHFFFAOYSA-N
XLogP1.02
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-N-ethyl-2-N-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80814989
4-chloro-N-[2-(1-methylimidazol-2-yl)ethyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 62863973
4-propan-2-yloxy-6-[(1-propylimidazol-2-yl)methyl]-1,3,5-triazin-2-amine
CID 79738576
4-butyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106659350
4-ethoxy-N-ethyl-6-[(1-propylimidazol-2-yl)methyl]-1,3,5-triazin-2-amine
CID 79733828
4-N-ethyl-2-N,2-N-dimethyl-6-[(1-methylimidazol-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 79738059
4-methyl-N-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxypyrimidin-2-amine
CID 112637652
4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 81346559
4-(1-methoxypropan-2-yloxy)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80880228
N-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 115943139
4-but-3-enoxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80861655
1-methyl-2-propan-2-yloxyimidazole
CID 59139379

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 79738564) is N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine is CNc1nc(Cc2nccn2C)nc(OC(C)C)n1.
What is the InChIKey of N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is TXQWPJUCOJSYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-8(2)19-12-16-9(15-11(13-3)17-12)7-10-14-5-6-18(10)4/h5-6,8H,7H2,1-4H3,(H,13,15,16,17).
What are the key properties of N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 262.32 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 79738564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).