N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride

C8H20Cl2N2 — CID 154878706

IUPACN,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride
SMILESCN(C)C1CNCC1(C)C.Cl.Cl
InChIInChI=1S/C8H18N2.2ClH/c1-8(2)6-9-5-7(8)10(3)4;;/h7,9H,5-6H2,1-4H3;2*1H
InChIKeyOCMSKKQVSNBFKG-UHFFFAOYSA-N
MW215.17 g/mol
LogP1.39
Rot. Bonds1

About N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride

N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride (PubChem CID 154878706) has the molecular formula C8H20Cl2N2 and a molecular weight of 215.17 g/mol. Its IUPAC name is N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride.

Molecular Properties

Compound NameN,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride
PubChem CID154878706
Molecular FormulaC8H20Cl2N2
Molecular Weight215.17 g/mol
Exact Mass214.10
IUPAC NameN,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride
SMILESCN(C)C1CNCC1(C)C.Cl.Cl
InChIInChI=1S/C8H18N2.2ClH/c1-8(2)6-9-5-7(8)10(3)4;;/h7,9H,5-6H2,1-4H3;2*1H
InChIKeyOCMSKKQVSNBFKG-UHFFFAOYSA-N
XLogP1.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.17
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride?
The IUPAC name of N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride (CID 154878706) is N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride.
What is the SMILES notation for N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride?
The canonical SMILES for N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride is CN(C)C1CNCC1(C)C.Cl.Cl.
What is the InChIKey of N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride?
The InChIKey is OCMSKKQVSNBFKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.2ClH/c1-8(2)6-9-5-7(8)10(3)4;;/h7,9H,5-6H2,1-4H3;2*1H.
What are the key properties of N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride?
N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride has a molecular weight of 215.17 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4,4-tetramethylpyrrolidin-3-amine;dihydrochloride is sourced from PubChem (CID 154878706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).