(2R)-1-(2-methylpropylamino)propan-2-ol

C7H17NO — CID 777887

IUPAC(2R)-1-(2-methylpropylamino)propan-2-ol
SMILESCC(C)CNC[C@@H](C)O
InChIInChI=1S/C7H17NO/c1-6(2)4-8-5-7(3)9/h6-9H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyUGDKQUJYHXHKDT-SSDOTTSWSA-N
MW131.22 g/mol
LogP0.61
Rot. Bonds4

About (2R)-1-(2-methylpropylamino)propan-2-ol

(2R)-1-(2-methylpropylamino)propan-2-ol (PubChem CID 777887) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is (2R)-1-(2-methylpropylamino)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(2-methylpropylamino)propan-2-ol
PubChem CID777887
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name(2R)-1-(2-methylpropylamino)propan-2-ol
SMILESCC(C)CNC[C@@H](C)O
InChIInChI=1S/C7H17NO/c1-6(2)4-8-5-7(3)9/h6-9H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyUGDKQUJYHXHKDT-SSDOTTSWSA-N
XLogP0.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-hydroxypropylamino)propan-2-ol;zinc
CID 175137712
1-(2-hydroxypropylamino)propan-2-ol;methane
CID 161456696
CID 175939227
CID 175939227
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
CID 519535
1-(hydroxymethylamino)propan-2-ol
CID 3018672
(2S)-1-(2-methylpropylamino)butan-2-ol
CID 130500218
butan-2-ol;1-(2-hydroxypropylamino)-4-methylpentan-2-ol
CID 158990832
1-[(3-amino-2-methylpropyl)amino]propan-2-ol
CID 130604418
1-(2,8-dimethylnonylamino)propan-2-ol
CID 21150228
2-[bis(2-hydroxyethyl)amino]ethanol;1-(2-hydroxypropylamino)propan-2-ol
CID 22218619
3-(2-hydroxypropylamino)-2-methylpropanamide
CID 43499862
2-hydroxy-3-[[(2R)-2-hydroxypropyl]amino]propanamide
CID 106174936

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-methylpropylamino)propan-2-ol?
The IUPAC name of (2R)-1-(2-methylpropylamino)propan-2-ol (CID 777887) is (2R)-1-(2-methylpropylamino)propan-2-ol.
What is the SMILES notation for (2R)-1-(2-methylpropylamino)propan-2-ol?
The canonical SMILES for (2R)-1-(2-methylpropylamino)propan-2-ol is CC(C)CNC[C@@H](C)O.
What is the InChIKey of (2R)-1-(2-methylpropylamino)propan-2-ol?
The InChIKey is UGDKQUJYHXHKDT-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H17NO/c1-6(2)4-8-5-7(3)9/h6-9H,4-5H2,1-3H3/t7-/m1/s1.
What are the key properties of (2R)-1-(2-methylpropylamino)propan-2-ol?
(2R)-1-(2-methylpropylamino)propan-2-ol has a molecular weight of 131.22 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-methylpropylamino)propan-2-ol is sourced from PubChem (CID 777887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).