(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine

C8H20N2 — CID 14963840

IUPAC(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine
SMILESCN[C@H](CN(C)C)C(C)C
InChIInChI=1S/C8H20N2/c1-7(2)8(9-3)6-10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1
InChIKeyHHXCARUSLFMXJA-MRVPVSSYSA-N
MW144.26 g/mol
LogP0.79
Rot. Bonds4

About (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine

(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine (PubChem CID 14963840) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine.

Molecular Properties

Compound Name(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine
PubChem CID14963840
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Name(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine
SMILESCN[C@H](CN(C)C)C(C)C
InChIInChI=1S/C8H20N2/c1-7(2)8(9-3)6-10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1
InChIKeyHHXCARUSLFMXJA-MRVPVSSYSA-N
XLogP0.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine?
The IUPAC name of (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine (CID 14963840) is (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine.
What is the SMILES notation for (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine?
The canonical SMILES for (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine is CN[C@H](CN(C)C)C(C)C.
What is the InChIKey of (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine?
The InChIKey is HHXCARUSLFMXJA-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H20N2/c1-7(2)8(9-3)6-10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1.
What are the key properties of (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine?
(2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-N,1-N,2-N,3-tetramethylbutane-1,2-diamine is sourced from PubChem (CID 14963840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).