ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium

C10H22N2O2Y — CID 158301038

IUPACethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium
SMILESCC.COC(C)(C)CC1COC(N)=N1.[Y]
InChIInChI=1S/C8H16N2O2.C2H6.Y/c1-8(2,11-3)4-6-5-12-7(9)10-6;1-2;/h6H,4-5H2,1-3H3,(H2,9,10);1-2H3;
InChIKeyGMMPRUSTQFLSFE-UHFFFAOYSA-N
MW291.20 g/mol
LogP1.54
Rot. Bonds3

About ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium

ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium (PubChem CID 158301038) has the molecular formula C10H22N2O2Y and a molecular weight of 291.20 g/mol. Its IUPAC name is ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium.

Molecular Properties

Compound Nameethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium
PubChem CID158301038
Molecular FormulaC10H22N2O2Y
Molecular Weight291.20 g/mol
Exact Mass291.07
IUPAC Nameethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium
SMILESCC.COC(C)(C)CC1COC(N)=N1.[Y]
InChIInChI=1S/C8H16N2O2.C2H6.Y/c1-8(2,11-3)4-6-5-12-7(9)10-6;1-2;/h6H,4-5H2,1-3H3,(H2,9,10);1-2H3;
InChIKeyGMMPRUSTQFLSFE-UHFFFAOYSA-N
XLogP1.54
TPSA56.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.20
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium?
The IUPAC name of ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium (CID 158301038) is ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium.
What is the SMILES notation for ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium?
The canonical SMILES for ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium is CC.COC(C)(C)CC1COC(N)=N1.[Y].
What is the InChIKey of ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium?
The InChIKey is GMMPRUSTQFLSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2.C2H6.Y/c1-8(2,11-3)4-6-5-12-7(9)10-6;1-2;/h6H,4-5H2,1-3H3,(H2,9,10);1-2H3;.
What are the key properties of ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium?
ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium has a molecular weight of 291.20 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(2-methoxy-2-methylpropyl)-4,5-dihydro-1,3-oxazol-2-amine;yttrium is sourced from PubChem (CID 158301038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).