4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine

C10H25N3 — CID 18364313

IUPAC4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine
SMILESCN(C)C(C)(CCCN)C(C)(C)N
InChIInChI=1S/C10H25N3/c1-9(2,12)10(3,13(4)5)7-6-8-11/h6-8,11-12H2,1-5H3
InChIKeyBSGJXAGUSOPXNJ-UHFFFAOYSA-N
MW187.33 g/mol
LogP0.78
Rot. Bonds5

About 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine

4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine (PubChem CID 18364313) has the molecular formula C10H25N3 and a molecular weight of 187.33 g/mol. Its IUPAC name is 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine.

Molecular Properties

Compound Name4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine
PubChem CID18364313
Molecular FormulaC10H25N3
Molecular Weight187.33 g/mol
Exact Mass187.20
IUPAC Name4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine
SMILESCN(C)C(C)(CCCN)C(C)(C)N
InChIInChI=1S/C10H25N3/c1-9(2,12)10(3,13(4)5)7-6-8-11/h6-8,11-12H2,1-5H3
InChIKeyBSGJXAGUSOPXNJ-UHFFFAOYSA-N
XLogP0.78
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine?
The IUPAC name of 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine (CID 18364313) is 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine.
What is the SMILES notation for 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine?
The canonical SMILES for 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine is CN(C)C(C)(CCCN)C(C)(C)N.
What is the InChIKey of 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine?
The InChIKey is BSGJXAGUSOPXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3/c1-9(2,12)10(3,13(4)5)7-6-8-11/h6-8,11-12H2,1-5H3.
What are the key properties of 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine?
4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine has a molecular weight of 187.33 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N,4,5-tetramethylhexane-1,4,5-triamine is sourced from PubChem (CID 18364313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).