2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine

C6H15N — CID 12556485

IUPAC2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine
SMILES[2H]C([2H])([2H])N(C([2H])([2H])[2H])C(C)(C)C
InChIInChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/i4D3,5D3
InChIKeyOXQMIXBVXHWDPX-RKAHMFOGSA-N
MW107.23 g/mol
LogP1.35
Rot. Bonds2

About 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine

2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine (PubChem CID 12556485) has the molecular formula C6H15N and a molecular weight of 107.23 g/mol. Its IUPAC name is 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine
PubChem CID12556485
Molecular FormulaC6H15N
Molecular Weight107.23 g/mol
Exact Mass107.16
IUPAC Name2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine
SMILES[2H]C([2H])([2H])N(C([2H])([2H])[2H])C(C)(C)C
InChIInChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/i4D3,5D3
InChIKeyOXQMIXBVXHWDPX-RKAHMFOGSA-N
XLogP1.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.23
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine?
The IUPAC name of 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine (CID 12556485) is 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine.
What is the SMILES notation for 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine?
The canonical SMILES for 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine is [2H]C([2H])([2H])N(C([2H])([2H])[2H])C(C)(C)C.
What is the InChIKey of 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine?
The InChIKey is OXQMIXBVXHWDPX-RKAHMFOGSA-N. The full InChI is InChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/i4D3,5D3.
What are the key properties of 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine?
2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine has a molecular weight of 107.23 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N,N-bis(trideuteriomethyl)propan-2-amine is sourced from PubChem (CID 12556485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).