1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine

C11H22N2O2 — CID 174777907

IUPAC1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine
SMILESCC(C)(N)CC1(CC(C)(C)N)OC=CO1
InChIInChI=1S/C11H22N2O2/c1-9(2,12)7-11(8-10(3,4)13)14-5-6-15-11/h5-6H,7-8,12-13H2,1-4H3
InChIKeyYPILZCMEIMEVFS-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.46
Rot. Bonds4

About 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine

1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine (PubChem CID 174777907) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine
PubChem CID174777907
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine
SMILESCC(C)(N)CC1(CC(C)(C)N)OC=CO1
InChIInChI=1S/C11H22N2O2/c1-9(2,12)7-11(8-10(3,4)13)14-5-6-15-11/h5-6H,7-8,12-13H2,1-4H3
InChIKeyYPILZCMEIMEVFS-UHFFFAOYSA-N
XLogP1.46
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine?
The IUPAC name of 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine (CID 174777907) is 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine.
What is the SMILES notation for 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine?
The canonical SMILES for 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine is CC(C)(N)CC1(CC(C)(C)N)OC=CO1.
What is the InChIKey of 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine?
The InChIKey is YPILZCMEIMEVFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2,12)7-11(8-10(3,4)13)14-5-6-15-11/h5-6H,7-8,12-13H2,1-4H3.
What are the key properties of 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine?
1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine has a molecular weight of 214.31 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-amino-2-methylpropyl)-1,3-dioxol-2-yl]-2-methylpropan-2-amine is sourced from PubChem (CID 174777907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).