2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine

C8H18N2O — CID 174918997

IUPAC2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine
SMILESCN(C)C1(N(C)C)CCCO1
InChIInChI=1S/C8H18N2O/c1-9(2)8(10(3)4)6-5-7-11-8/h5-7H2,1-4H3
InChIKeyBWMQPOHLEKHYQI-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.57
Rot. Bonds2

About 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine

2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine (PubChem CID 174918997) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine.

Molecular Properties

Compound Name2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine
PubChem CID174918997
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine
SMILESCN(C)C1(N(C)C)CCCO1
InChIInChI=1S/C8H18N2O/c1-9(2)8(10(3)4)6-5-7-11-8/h5-7H2,1-4H3
InChIKeyBWMQPOHLEKHYQI-UHFFFAOYSA-N
XLogP0.57
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine?
The IUPAC name of 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine (CID 174918997) is 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine.
What is the SMILES notation for 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine?
The canonical SMILES for 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine is CN(C)C1(N(C)C)CCCO1.
What is the InChIKey of 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine?
The InChIKey is BWMQPOHLEKHYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-9(2)8(10(3)4)6-5-7-11-8/h5-7H2,1-4H3.
What are the key properties of 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine?
2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine has a molecular weight of 158.24 g/mol, XLogP of 0.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,2-N',2-N'-tetramethyloxolane-2,2-diamine is sourced from PubChem (CID 174918997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).