2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine

C16H26N2O — CID 79928473

IUPAC2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine
SMILESCN(C)c1ccccc1NC1CC(C)(C)OC1(C)C
InChIInChI=1S/C16H26N2O/c1-15(2)11-14(16(3,4)19-15)17-12-9-7-8-10-13(12)18(5)6/h7-10,14,17H,11H2,1-6H3
InChIKeyYZVOBTMXGFBTCR-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.51
Rot. Bonds3

About 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine

2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine (PubChem CID 79928473) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine
PubChem CID79928473
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine
SMILESCN(C)c1ccccc1NC1CC(C)(C)OC1(C)C
InChIInChI=1S/C16H26N2O/c1-15(2)11-14(16(3,4)19-15)17-12-9-7-8-10-13(12)18(5)6/h7-10,14,17H,11H2,1-6H3
InChIKeyYZVOBTMXGFBTCR-UHFFFAOYSA-N
XLogP3.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.51
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-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine?
The IUPAC name of 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine (CID 79928473) is 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine is CN(C)c1ccccc1NC1CC(C)(C)OC1(C)C.
What is the InChIKey of 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine?
The InChIKey is YZVOBTMXGFBTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-15(2)11-14(16(3,4)19-15)17-12-9-7-8-10-13(12)18(5)6/h7-10,14,17H,11H2,1-6H3.
What are the key properties of 2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine?
2-N,2-N-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine has a molecular weight of 262.40 g/mol, XLogP of 3.51, 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-dimethyl-1-N-(2,2,5,5-tetramethyloxolan-3-yl)benzene-1,2-diamine is sourced from PubChem (CID 79928473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).