(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol

C8H20N2O — CID 106932409

IUPAC(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
SMILESCC(CN(C)C)NC[C@@H](C)O
InChIInChI=1S/C8H20N2O/c1-7(6-10(3)4)9-5-8(2)11/h7-9,11H,5-6H2,1-4H3/t7?,8-/m1/s1
InChIKeyAOUMVMZGBFBTNG-BRFYHDHCSA-N
MW160.26 g/mol
LogP-0.09
Rot. Bonds5

About (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol

(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol (PubChem CID 106932409) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
PubChem CID106932409
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
SMILESCC(CN(C)C)NC[C@@H](C)O
InChIInChI=1S/C8H20N2O/c1-7(6-10(3)4)9-5-8(2)11/h7-9,11H,5-6H2,1-4H3/t7?,8-/m1/s1
InChIKeyAOUMVMZGBFBTNG-BRFYHDHCSA-N
XLogP-0.09
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol?
The IUPAC name of (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol (CID 106932409) is (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol.
What is the SMILES notation for (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol?
The canonical SMILES for (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol is CC(CN(C)C)NC[C@@H](C)O.
What is the InChIKey of (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol?
The InChIKey is AOUMVMZGBFBTNG-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H20N2O/c1-7(6-10(3)4)9-5-8(2)11/h7-9,11H,5-6H2,1-4H3/t7?,8-/m1/s1.
What are the key properties of (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol?
(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol has a molecular weight of 160.26 g/mol, XLogP of -0.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol is sourced from PubChem (CID 106932409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).