1-(2-hydroxypropylamino)propan-2-ol;methane

C7H19NO2 — CID 161456696

IUPAC1-(2-hydroxypropylamino)propan-2-ol;methane
SMILESC.CC(O)CNCC(C)O
InChIInChI=1S/C6H15NO2.CH4/c1-5(8)3-7-4-6(2)9;/h5-9H,3-4H2,1-2H3;1H4
InChIKeyWBGBAOXYAMHOPW-UHFFFAOYSA-N
MW149.23 g/mol
LogP-0.03
Rot. Bonds4

About 1-(2-hydroxypropylamino)propan-2-ol;methane

1-(2-hydroxypropylamino)propan-2-ol;methane (PubChem CID 161456696) has the molecular formula C7H19NO2 and a molecular weight of 149.23 g/mol. Its IUPAC name is 1-(2-hydroxypropylamino)propan-2-ol;methane.

Molecular Properties

Compound Name1-(2-hydroxypropylamino)propan-2-ol;methane
PubChem CID161456696
Molecular FormulaC7H19NO2
Molecular Weight149.23 g/mol
Exact Mass149.14
IUPAC Name1-(2-hydroxypropylamino)propan-2-ol;methane
SMILESC.CC(O)CNCC(C)O
InChIInChI=1S/C6H15NO2.CH4/c1-5(8)3-7-4-6(2)9;/h5-9H,3-4H2,1-2H3;1H4
InChIKeyWBGBAOXYAMHOPW-UHFFFAOYSA-N
XLogP-0.03
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.23
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-hydroxypropylamino)propan-2-ol;zinc
CID 175137712
(2R)-1-(2-methylpropylamino)propan-2-ol
CID 777887
1-(hydroxymethylamino)propan-2-ol
CID 3018672
1-[(3-amino-2-methylpropyl)amino]propan-2-ol
CID 130604418
2-[bis(2-hydroxyethyl)amino]ethanol;1-(2-hydroxypropylamino)propan-2-ol
CID 22218619
2-hydroxy-3-[[(2R)-2-hydroxypropyl]amino]propanamide
CID 106174936
3-(2-hydroxypropylamino)-2-methylpropanamide
CID 43499862
1-(2,2-dimethylpropylamino)propan-2-ol
CID 21304828
(2R)-1-[2-(methylamino)ethylamino]propan-2-ol
CID 143132001
butan-2-ol;1-(2-hydroxypropylamino)-4-methylpentan-2-ol
CID 158990832
3-[[[(2R)-2-hydroxypropyl]amino]methyl]pentan-1-ol
CID 106932322
1-(2-hydroxyethylamino)propan-2-ol;propane
CID 145289862

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxypropylamino)propan-2-ol;methane?
The IUPAC name of 1-(2-hydroxypropylamino)propan-2-ol;methane (CID 161456696) is 1-(2-hydroxypropylamino)propan-2-ol;methane.
What is the SMILES notation for 1-(2-hydroxypropylamino)propan-2-ol;methane?
The canonical SMILES for 1-(2-hydroxypropylamino)propan-2-ol;methane is C.CC(O)CNCC(C)O.
What is the InChIKey of 1-(2-hydroxypropylamino)propan-2-ol;methane?
The InChIKey is WBGBAOXYAMHOPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2.CH4/c1-5(8)3-7-4-6(2)9;/h5-9H,3-4H2,1-2H3;1H4.
What are the key properties of 1-(2-hydroxypropylamino)propan-2-ol;methane?
1-(2-hydroxypropylamino)propan-2-ol;methane has a molecular weight of 149.23 g/mol, XLogP of -0.03, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxypropylamino)propan-2-ol;methane is sourced from PubChem (CID 161456696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).