1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine

C12H22N2O — CID 115084227

IUPAC1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1coc(CC(C)(C)C)n1
InChIInChI=1S/C12H22N2O/c1-9(13-5)6-10-8-15-11(14-10)7-12(2,3)4/h8-9,13H,6-7H2,1-5H3
InChIKeyGDMSCCDYAZNLNK-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.41
Rot. Bonds4

About 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine

1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine (PubChem CID 115084227) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine
PubChem CID115084227
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1coc(CC(C)(C)C)n1
InChIInChI=1S/C12H22N2O/c1-9(13-5)6-10-8-15-11(14-10)7-12(2,3)4/h8-9,13H,6-7H2,1-5H3
InChIKeyGDMSCCDYAZNLNK-UHFFFAOYSA-N
XLogP2.41
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine 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

1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylethanamine
CID 115084216
3-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-1-amine
CID 115084234
1-[2-[(3-methoxyphenyl)methyl]-1,3-oxazol-4-yl]-N-methylpropan-2-amine
CID 115083827
N-methyl-1-[2-[(1-propan-2-ylpiperidin-3-yl)methyl]-1,3-oxazol-4-yl]propan-2-amine
CID 115083475
2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole
CID 89177733
N-methyl-2-[2-(2-methylpropyl)-1,3-oxazol-4-yl]ethanamine
CID 115084221
N-methyl-1-[2-(oxan-2-yl)-1,3-oxazol-4-yl]propan-2-amine
CID 115082978
N-methyl-1-[2-(oxan-3-yl)-1,3-oxazol-4-yl]propan-2-amine
CID 115082682
1-[2-(2-methylpropyl)-1,3-oxazol-4-yl]propan-2-ol
CID 115084190
methyl 2-[2-(methylamino)propyl]-1,3-oxazole-4-carboxylate
CID 105451384
2-[4-(2-methylpropyl)-1,3-oxazol-2-yl]ethanamine
CID 105433846
4-[2,2-dimethyl-3-(1-methylpiperidin-4-yl)propyl]-2-(2,2-dimethylpropyl)-1,3-oxazole
CID 146254888

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine?
The IUPAC name of 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine (CID 115084227) is 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine.
What is the SMILES notation for 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine?
The canonical SMILES for 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine is CNC(C)Cc1coc(CC(C)(C)C)n1.
What is the InChIKey of 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine?
The InChIKey is GDMSCCDYAZNLNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9(13-5)6-10-8-15-11(14-10)7-12(2,3)4/h8-9,13H,6-7H2,1-5H3.
What are the key properties of 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine?
1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine has a molecular weight of 210.32 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,2-dimethylpropyl)-1,3-oxazol-4-yl]-N-methylpropan-2-amine is sourced from PubChem (CID 115084227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).