(2S)-2-(methylamino)propan-1-ol

C4H11NO — CID 12695786

IUPAC(2S)-2-(methylamino)propan-1-ol
SMILESCN[C@@H](C)CO
InChIInChI=1S/C4H11NO/c1-4(3-6)5-2/h4-6H,3H2,1-2H3/t4-/m0/s1
InChIKeyPXWASTUQOKUFKY-BYPYZUCNSA-N
MW89.14 g/mol
LogP-0.41
Rot. Bonds2

About (2S)-2-(methylamino)propan-1-ol

(2S)-2-(methylamino)propan-1-ol (PubChem CID 12695786) has the molecular formula C4H11NO and a molecular weight of 89.14 g/mol. Its IUPAC name is (2S)-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name(2S)-2-(methylamino)propan-1-ol
PubChem CID12695786
Molecular FormulaC4H11NO
Molecular Weight89.14 g/mol
Exact Mass89.08
IUPAC Name(2S)-2-(methylamino)propan-1-ol
SMILESCN[C@@H](C)CO
InChIInChI=1S/C4H11NO/c1-4(3-6)5-2/h4-6H,3H2,1-2H3/t4-/m0/s1
InChIKeyPXWASTUQOKUFKY-BYPYZUCNSA-N
XLogP-0.41
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.14
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(methylamino)propan-1-ol?
The IUPAC name of (2S)-2-(methylamino)propan-1-ol (CID 12695786) is (2S)-2-(methylamino)propan-1-ol.
What is the SMILES notation for (2S)-2-(methylamino)propan-1-ol?
The canonical SMILES for (2S)-2-(methylamino)propan-1-ol is CN[C@@H](C)CO.
What is the InChIKey of (2S)-2-(methylamino)propan-1-ol?
The InChIKey is PXWASTUQOKUFKY-BYPYZUCNSA-N. The full InChI is InChI=1S/C4H11NO/c1-4(3-6)5-2/h4-6H,3H2,1-2H3/t4-/m0/s1.
What are the key properties of (2S)-2-(methylamino)propan-1-ol?
(2S)-2-(methylamino)propan-1-ol has a molecular weight of 89.14 g/mol, XLogP of -0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(methylamino)propan-1-ol is sourced from PubChem (CID 12695786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).