1-N,2-N,2-N-triethylpentane-1,2-diamine

C11H26N2 — CID 83043312

IUPAC1-N,2-N,2-N-triethylpentane-1,2-diamine
SMILESCCCC(CNCC)N(CC)CC
InChIInChI=1S/C11H26N2/c1-5-9-11(10-12-6-2)13(7-3)8-4/h11-12H,5-10H2,1-4H3
InChIKeyCBRVRGMYFPXWFY-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.11
Rot. Bonds8

About 1-N,2-N,2-N-triethylpentane-1,2-diamine

1-N,2-N,2-N-triethylpentane-1,2-diamine (PubChem CID 83043312) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is 1-N,2-N,2-N-triethylpentane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-N-triethylpentane-1,2-diamine
PubChem CID83043312
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Name1-N,2-N,2-N-triethylpentane-1,2-diamine
SMILESCCCC(CNCC)N(CC)CC
InChIInChI=1S/C11H26N2/c1-5-9-11(10-12-6-2)13(7-3)8-4/h11-12H,5-10H2,1-4H3
InChIKeyCBRVRGMYFPXWFY-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-N-triethylpentane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-N-triethylpentane-1,2-diamine (CID 83043312) is 1-N,2-N,2-N-triethylpentane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-N-triethylpentane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-N-triethylpentane-1,2-diamine is CCCC(CNCC)N(CC)CC.
What is the InChIKey of 1-N,2-N,2-N-triethylpentane-1,2-diamine?
The InChIKey is CBRVRGMYFPXWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2/c1-5-9-11(10-12-6-2)13(7-3)8-4/h11-12H,5-10H2,1-4H3.
What are the key properties of 1-N,2-N,2-N-triethylpentane-1,2-diamine?
1-N,2-N,2-N-triethylpentane-1,2-diamine has a molecular weight of 186.34 g/mol, XLogP of 2.11, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-N-triethylpentane-1,2-diamine is sourced from PubChem (CID 83043312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).