2,2,5,5-tetramethylhexane-3,4-diamine

C10H24N2 — CID 18175385

IUPAC2,2,5,5-tetramethylhexane-3,4-diamine
SMILESCC(C)(C)C(N)C(N)C(C)(C)C
InChIInChI=1S/C10H24N2/c1-9(2,3)7(11)8(12)10(4,5)6/h7-8H,11-12H2,1-6H3
InChIKeyWROMFDZPVVQJRK-UHFFFAOYSA-N
MW172.32 g/mol
LogP1.73
Rot. Bonds1

About 2,2,5,5-tetramethylhexane-3,4-diamine

2,2,5,5-tetramethylhexane-3,4-diamine (PubChem CID 18175385) has the molecular formula C10H24N2 and a molecular weight of 172.32 g/mol. Its IUPAC name is 2,2,5,5-tetramethylhexane-3,4-diamine.

Molecular Properties

Compound Name2,2,5,5-tetramethylhexane-3,4-diamine
PubChem CID18175385
Molecular FormulaC10H24N2
Molecular Weight172.32 g/mol
Exact Mass172.19
IUPAC Name2,2,5,5-tetramethylhexane-3,4-diamine
SMILESCC(C)(C)C(N)C(N)C(C)(C)C
InChIInChI=1S/C10H24N2/c1-9(2,3)7(11)8(12)10(4,5)6/h7-8H,11-12H2,1-6H3
InChIKeyWROMFDZPVVQJRK-UHFFFAOYSA-N
XLogP1.73
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.32
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethylhexane-3,4-diamine?
The IUPAC name of 2,2,5,5-tetramethylhexane-3,4-diamine (CID 18175385) is 2,2,5,5-tetramethylhexane-3,4-diamine.
What is the SMILES notation for 2,2,5,5-tetramethylhexane-3,4-diamine?
The canonical SMILES for 2,2,5,5-tetramethylhexane-3,4-diamine is CC(C)(C)C(N)C(N)C(C)(C)C.
What is the InChIKey of 2,2,5,5-tetramethylhexane-3,4-diamine?
The InChIKey is WROMFDZPVVQJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2/c1-9(2,3)7(11)8(12)10(4,5)6/h7-8H,11-12H2,1-6H3.
What are the key properties of 2,2,5,5-tetramethylhexane-3,4-diamine?
2,2,5,5-tetramethylhexane-3,4-diamine has a molecular weight of 172.32 g/mol, XLogP of 1.73, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethylhexane-3,4-diamine is sourced from PubChem (CID 18175385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).