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

C8H20N2 — CID 30428933

IUPAC(2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine
SMILESCN(C)C[C@@H](N)C(C)(C)C
InChIInChI=1S/C8H20N2/c1-8(2,3)7(9)6-10(4)5/h7H,6,9H2,1-5H3/t7-/m1/s1
InChIKeyDRLDXRDPJZGMFU-SSDOTTSWSA-N
MW144.26 g/mol
LogP0.92
Rot. Bonds2

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

(2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine (PubChem CID 30428933) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine.

Molecular Properties

Compound Name(2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine
PubChem CID30428933
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Name(2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine
SMILESCN(C)C[C@@H](N)C(C)(C)C
InChIInChI=1S/C8H20N2/c1-8(2,3)7(9)6-10(4)5/h7H,6,9H2,1-5H3/t7-/m1/s1
InChIKeyDRLDXRDPJZGMFU-SSDOTTSWSA-N
XLogP0.92
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 50.92
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,3,3-tetramethylbutane-1,2-diamine?
The IUPAC name of (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine (CID 30428933) is (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine.
What is the SMILES notation for (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine?
The canonical SMILES for (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine is CN(C)C[C@@H](N)C(C)(C)C.
What is the InChIKey of (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine?
The InChIKey is DRLDXRDPJZGMFU-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H20N2/c1-8(2,3)7(9)6-10(4)5/h7H,6,9H2,1-5H3/t7-/m1/s1.
What are the key properties of (2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine?
(2S)-1-N,1-N,3,3-tetramethylbutane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 0.92, 2 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,3,3-tetramethylbutane-1,2-diamine is sourced from PubChem (CID 30428933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).