(1R)-1-(dimethylamino)ethanol

C4H11NO — CID 93477762

IUPAC(1R)-1-(dimethylamino)ethanol
SMILESC[C@@H](O)N(C)C
InChIInChI=1S/C4H11NO/c1-4(6)5(2)3/h4,6H,1-3H3/t4-/m1/s1
InChIKeyMDLKWDQMIZRIBY-SCSAIBSYSA-N
MW89.14 g/mol
LogP-0.11
Rot. Bonds1

About (1R)-1-(dimethylamino)ethanol

(1R)-1-(dimethylamino)ethanol (PubChem CID 93477762) has the molecular formula C4H11NO and a molecular weight of 89.14 g/mol. Its IUPAC name is (1R)-1-(dimethylamino)ethanol.

Molecular Properties

Compound Name(1R)-1-(dimethylamino)ethanol
PubChem CID93477762
Molecular FormulaC4H11NO
Molecular Weight89.14 g/mol
Exact Mass89.08
IUPAC Name(1R)-1-(dimethylamino)ethanol
SMILESC[C@@H](O)N(C)C
InChIInChI=1S/C4H11NO/c1-4(6)5(2)3/h4,6H,1-3H3/t4-/m1/s1
InChIKeyMDLKWDQMIZRIBY-SCSAIBSYSA-N
XLogP-0.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.14
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(dimethylamino)ethanol?
The IUPAC name of (1R)-1-(dimethylamino)ethanol (CID 93477762) is (1R)-1-(dimethylamino)ethanol.
What is the SMILES notation for (1R)-1-(dimethylamino)ethanol?
The canonical SMILES for (1R)-1-(dimethylamino)ethanol is C[C@@H](O)N(C)C.
What is the InChIKey of (1R)-1-(dimethylamino)ethanol?
The InChIKey is MDLKWDQMIZRIBY-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H11NO/c1-4(6)5(2)3/h4,6H,1-3H3/t4-/m1/s1.
What are the key properties of (1R)-1-(dimethylamino)ethanol?
(1R)-1-(dimethylamino)ethanol has a molecular weight of 89.14 g/mol, XLogP of -0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(dimethylamino)ethanol is sourced from PubChem (CID 93477762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).