N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine

C11H19N3O — CID 106578773

IUPACN-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine
SMILESCc1cnc(NC2CCOC(C)(C)C2)[nH]1
InChIInChI=1S/C11H19N3O/c1-8-7-12-10(13-8)14-9-4-5-15-11(2,3)6-9/h7,9H,4-6H2,1-3H3,(H2,12,13,14)
InChIKeyVBIOQUBPYOPFFY-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.09
Rot. Bonds2

About N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine

N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine (PubChem CID 106578773) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine
PubChem CID106578773
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine
SMILESCc1cnc(NC2CCOC(C)(C)C2)[nH]1
InChIInChI=1S/C11H19N3O/c1-8-7-12-10(13-8)14-9-4-5-15-11(2,3)6-9/h7,9H,4-6H2,1-3H3,(H2,12,13,14)
InChIKeyVBIOQUBPYOPFFY-UHFFFAOYSA-N
XLogP2.09
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-1H-1,2,4-triazol-5-amine
CID 67009275
5-methyl-N-(oxolan-3-yl)-1H-imidazol-2-amine
CID 106577304
N-(2,2-dimethyloxan-4-yl)-1H-imidazol-2-amine
CID 106578747
2-N-(2,2-dimethyloxan-4-yl)-5-methylpyridine-2,3-diamine
CID 83027015
2-N-(2,2-dimethyloxan-4-yl)pyrazine-2,5-diamine
CID 83040320
5-[(2,2-dimethyloxan-4-yl)amino]pyrazine-2-carbonitrile
CID 83029223
N-(2,2-dimethyloxan-4-yl)-6-methylpyridin-2-amine
CID 83028574
N-(2,2-dimethyloxan-4-yl)-5-nitropyridin-2-amine
CID 113336591
N-(2,2-dimethyloxan-4-yl)-2-methylpyridin-3-amine
CID 79042204
N-(2,2-dimethyloxan-4-yl)pyridin-4-amine
CID 83028490
2-N-(2,2-dimethyloxan-4-yl)-4-methylpyridine-2,3-diamine
CID 83027817
6-[(2,2-dimethyloxan-4-yl)amino]pyridine-2-carbonitrile
CID 113336612

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine (CID 106578773) is N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine is Cc1cnc(NC2CCOC(C)(C)C2)[nH]1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine?
The InChIKey is VBIOQUBPYOPFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8-7-12-10(13-8)14-9-4-5-15-11(2,3)6-9/h7,9H,4-6H2,1-3H3,(H2,12,13,14).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine?
N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine has a molecular weight of 209.29 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-5-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 106578773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).