3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol

C10H24N2O — CID 81411342

IUPAC3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol
SMILESCC(CNCC(C)(C)CO)N(C)C
InChIInChI=1S/C10H24N2O/c1-9(12(4)5)6-11-7-10(2,3)8-13/h9,11,13H,6-8H2,1-5H3
InChIKeyTWEZOODCTQRCOI-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.54
Rot. Bonds6

About 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol

3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol (PubChem CID 81411342) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol.

Molecular Properties

Compound Name3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol
PubChem CID81411342
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol
SMILESCC(CNCC(C)(C)CO)N(C)C
InChIInChI=1S/C10H24N2O/c1-9(12(4)5)6-11-7-10(2,3)8-13/h9,11,13H,6-8H2,1-5H3
InChIKeyTWEZOODCTQRCOI-UHFFFAOYSA-N
XLogP0.54
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol?
The IUPAC name of 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol (CID 81411342) is 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol.
What is the SMILES notation for 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol?
The canonical SMILES for 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol is CC(CNCC(C)(C)CO)N(C)C.
What is the InChIKey of 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol?
The InChIKey is TWEZOODCTQRCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-9(12(4)5)6-11-7-10(2,3)8-13/h9,11,13H,6-8H2,1-5H3.
What are the key properties of 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol?
3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol has a molecular weight of 188.31 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)propylamino]-2,2-dimethylpropan-1-ol is sourced from PubChem (CID 81411342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).