(2R)-1-[2-(methylamino)ethylamino]propan-2-ol

C6H16N2O — CID 143132001

IUPAC(2R)-1-[2-(methylamino)ethylamino]propan-2-ol
SMILESCNCCNC[C@@H](C)O
InChIInChI=1S/C6H16N2O/c1-6(9)5-8-4-3-7-2/h6-9H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyOMWVWILJIRTNPF-ZCFIWIBFSA-N
MW132.21 g/mol
LogP-0.82
Rot. Bonds5

About (2R)-1-[2-(methylamino)ethylamino]propan-2-ol

(2R)-1-[2-(methylamino)ethylamino]propan-2-ol (PubChem CID 143132001) has the molecular formula C6H16N2O and a molecular weight of 132.21 g/mol. Its IUPAC name is (2R)-1-[2-(methylamino)ethylamino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[2-(methylamino)ethylamino]propan-2-ol
PubChem CID143132001
Molecular FormulaC6H16N2O
Molecular Weight132.21 g/mol
Exact Mass132.13
IUPAC Name(2R)-1-[2-(methylamino)ethylamino]propan-2-ol
SMILESCNCCNC[C@@H](C)O
InChIInChI=1S/C6H16N2O/c1-6(9)5-8-4-3-7-2/h6-9H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyOMWVWILJIRTNPF-ZCFIWIBFSA-N
XLogP-0.82
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 5-0.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(propan-2-ylamino)ethylamino]propan-2-ol
CID 104594507
1-(2-hydroxypropylamino)propan-2-ol;zinc
CID 175137712
1-(2-hydroxypropylamino)propan-2-ol;methane
CID 161456696
1-(2-hydroxyethylamino)propan-2-ol;propane
CID 145289862
5-[[(2R)-2-hydroxypropyl]amino]pentan-2-ol
CID 106131822
1,1,1-trifluoro-3-[2-(methylamino)ethylamino]propan-2-ol
CID 123282561
2-hydroxy-1-[2-(sulfamoylamino)ethylamino]propane
CID 114959448
1-(3-silylpropylamino)propan-2-ol
CID 165030604
1-(pentylamino)propan-2-ol
CID 3016247
1-(hydroxymethylamino)propan-2-ol
CID 3018672
(2R)-1-(2-methylpropylamino)propan-2-ol
CID 777887
1-[[(2R)-2-hydroxypropyl]amino]pentan-3-ol
CID 106932604

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(methylamino)ethylamino]propan-2-ol?
The IUPAC name of (2R)-1-[2-(methylamino)ethylamino]propan-2-ol (CID 143132001) is (2R)-1-[2-(methylamino)ethylamino]propan-2-ol.
What is the SMILES notation for (2R)-1-[2-(methylamino)ethylamino]propan-2-ol?
The canonical SMILES for (2R)-1-[2-(methylamino)ethylamino]propan-2-ol is CNCCNC[C@@H](C)O.
What is the InChIKey of (2R)-1-[2-(methylamino)ethylamino]propan-2-ol?
The InChIKey is OMWVWILJIRTNPF-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H16N2O/c1-6(9)5-8-4-3-7-2/h6-9H,3-5H2,1-2H3/t6-/m1/s1.
What are the key properties of (2R)-1-[2-(methylamino)ethylamino]propan-2-ol?
(2R)-1-[2-(methylamino)ethylamino]propan-2-ol has a molecular weight of 132.21 g/mol, XLogP of -0.82, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(methylamino)ethylamino]propan-2-ol is sourced from PubChem (CID 143132001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).