2-N',2-N'-dimethylpropane-2,2-diamine

C5H14N2 — CID 15097057

IUPAC2-N',2-N'-dimethylpropane-2,2-diamine
SMILESCN(C)C(C)(C)N
InChIInChI=1S/C5H14N2/c1-5(2,6)7(3)4/h6H2,1-4H3
InChIKeyZJKFTPOETPLINY-UHFFFAOYSA-N
MW102.18 g/mol
LogP0.24
Rot. Bonds1

About 2-N',2-N'-dimethylpropane-2,2-diamine

2-N',2-N'-dimethylpropane-2,2-diamine (PubChem CID 15097057) has the molecular formula C5H14N2 and a molecular weight of 102.18 g/mol. Its IUPAC name is 2-N',2-N'-dimethylpropane-2,2-diamine.

Molecular Properties

Compound Name2-N',2-N'-dimethylpropane-2,2-diamine
PubChem CID15097057
Molecular FormulaC5H14N2
Molecular Weight102.18 g/mol
Exact Mass102.12
IUPAC Name2-N',2-N'-dimethylpropane-2,2-diamine
SMILESCN(C)C(C)(C)N
InChIInChI=1S/C5H14N2/c1-5(2,6)7(3)4/h6H2,1-4H3
InChIKeyZJKFTPOETPLINY-UHFFFAOYSA-N
XLogP0.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.18
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'-dimethylpropane-2,2-diamine?
The IUPAC name of 2-N',2-N'-dimethylpropane-2,2-diamine (CID 15097057) is 2-N',2-N'-dimethylpropane-2,2-diamine.
What is the SMILES notation for 2-N',2-N'-dimethylpropane-2,2-diamine?
The canonical SMILES for 2-N',2-N'-dimethylpropane-2,2-diamine is CN(C)C(C)(C)N.
What is the InChIKey of 2-N',2-N'-dimethylpropane-2,2-diamine?
The InChIKey is ZJKFTPOETPLINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2/c1-5(2,6)7(3)4/h6H2,1-4H3.
What are the key properties of 2-N',2-N'-dimethylpropane-2,2-diamine?
2-N',2-N'-dimethylpropane-2,2-diamine has a molecular weight of 102.18 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N',2-N'-dimethylpropane-2,2-diamine is sourced from PubChem (CID 15097057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).