(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol

C9H21NO2 — CID 103935283

IUPAC(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
SMILESCC(C)OCCN(C)C[C@H](C)O
InChIInChI=1S/C9H21NO2/c1-8(2)12-6-5-10(4)7-9(3)11/h8-9,11H,5-7H2,1-4H3/t9-/m0/s1
InChIKeyZAOJZQLRTXMJLV-VIFPVBQESA-N
MW175.27 g/mol
LogP0.72
Rot. Bonds6

About (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol

(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol (PubChem CID 103935283) has the molecular formula C9H21NO2 and a molecular weight of 175.27 g/mol. Its IUPAC name is (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol.

Molecular Properties

Compound Name(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
PubChem CID103935283
Molecular FormulaC9H21NO2
Molecular Weight175.27 g/mol
Exact Mass175.16
IUPAC Name(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
SMILESCC(C)OCCN(C)C[C@H](C)O
InChIInChI=1S/C9H21NO2/c1-8(2)12-6-5-10(4)7-9(3)11/h8-9,11H,5-7H2,1-4H3/t9-/m0/s1
InChIKeyZAOJZQLRTXMJLV-VIFPVBQESA-N
XLogP0.72
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-3-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 112561816
2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propan-1-ol
CID 115665678
2,2-dimethoxy-N-methyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 81057838
1-ethoxy-3-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 80710339
2-amino-3-[methyl(2-propan-2-yloxyethyl)amino]propanamide
CID 81062306
1-(cyclopropylamino)-3-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 81058826
3-[methyl(2-propan-2-yloxyethyl)amino]-2-(propan-2-ylamino)propanoic acid
CID 81061472
3,3-dimethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butane-1-thiol
CID 81062955
ethane;2-[methyl(2-propan-2-yloxyethyl)amino]acetic acid
CID 156795596
1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
CID 81058667
1-[methyl(2-propan-2-yloxyethyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 81055538
3,3,3-trifluoro-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]propanethioamide
CID 103368794

Frequently Asked Questions

What is the IUPAC name of (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol?
The IUPAC name of (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol (CID 103935283) is (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol.
What is the SMILES notation for (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol?
The canonical SMILES for (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol is CC(C)OCCN(C)C[C@H](C)O.
What is the InChIKey of (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol?
The InChIKey is ZAOJZQLRTXMJLV-VIFPVBQESA-N. The full InChI is InChI=1S/C9H21NO2/c1-8(2)12-6-5-10(4)7-9(3)11/h8-9,11H,5-7H2,1-4H3/t9-/m0/s1.
What are the key properties of (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol?
(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol has a molecular weight of 175.27 g/mol, XLogP of 0.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol is sourced from PubChem (CID 103935283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).