2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine

C14H30N2O — CID 114623219

IUPAC2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine
SMILESCN(C)C(C)(C)C(N)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)9-10(14(5,6)17-12)11(15)13(3,4)16(7)8/h10-11H,9,15H2,1-8H3
InChIKeyPXORCNPBMIMUAD-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.25
Rot. Bonds3

About 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine

2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine (PubChem CID 114623219) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine
PubChem CID114623219
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine
SMILESCN(C)C(C)(C)C(N)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)9-10(14(5,6)17-12)11(15)13(3,4)16(7)8/h10-11H,9,15H2,1-8H3
InChIKeyPXORCNPBMIMUAD-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine?
The IUPAC name of 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine (CID 114623219) is 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine?
The canonical SMILES for 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine is CN(C)C(C)(C)C(N)C1CC(C)(C)OC1(C)C.
What is the InChIKey of 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine?
The InChIKey is PXORCNPBMIMUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)9-10(14(5,6)17-12)11(15)13(3,4)16(7)8/h10-11H,9,15H2,1-8H3.
What are the key properties of 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine?
2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,2-trimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propane-1,2-diamine is sourced from PubChem (CID 114623219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).