2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol

C10H23NO2 — CID 106939709

IUPAC2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol
SMILESCC(C)NCCCOCC(C)(C)O
InChIInChI=1S/C10H23NO2/c1-9(2)11-6-5-7-13-8-10(3,4)12/h9,11-12H,5-8H2,1-4H3
InChIKeyUDDIOIPZKCURMD-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.16
Rot. Bonds7

About 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol

2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol (PubChem CID 106939709) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol
PubChem CID106939709
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol
SMILESCC(C)NCCCOCC(C)(C)O
InChIInChI=1S/C10H23NO2/c1-9(2)11-6-5-7-13-8-10(3,4)12/h9,11-12H,5-8H2,1-4H3
InChIKeyUDDIOIPZKCURMD-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,2-dimethyl-N-[3-[3-(propan-2-ylamino)propoxy]propyl]propanamide
CID 170038260
N'-propan-2-yl-N-[3-(2,2,2-trifluoroethoxy)propyl]propane-1,3-diamine
CID 103208163
5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-N-propan-2-ylpentan-1-amine
CID 112590039
methyl 3-[3-(propan-2-ylamino)propoxy]propanoate
CID 106939689
4-pentoxy-N-propan-2-ylbutan-1-amine
CID 62449715
N-[2-[3-[2-(propan-2-ylamino)ethoxy]-2,2-bis[2-(propan-2-ylamino)ethoxymethyl]propoxy]ethyl]propan-2-amine
CID 140945350
4-[2-(2-ethoxyethoxy)ethoxy]-N-propan-2-ylbutan-1-amine
CID 146693023
1-[3-[3-(propan-2-ylamino)propoxy]propylamino]propane-2-thiol
CID 167242562
ethane;N-[3-[2-[2-[3-(propan-2-ylamino)propoxy]ethoxy]ethoxy]propyl]propanamide
CID 166555356
N-ethyl-3-[3-(propan-2-ylamino)propoxy]propanamide
CID 62342053
5-(2-cyclopropylethoxy)-N-propan-2-ylpentan-1-amine
CID 106205729
4-(3-methylbut-3-enoxy)-N-propan-2-ylbutan-1-amine
CID 114470721

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol?
The IUPAC name of 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol (CID 106939709) is 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol?
The canonical SMILES for 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol is CC(C)NCCCOCC(C)(C)O.
What is the InChIKey of 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol?
The InChIKey is UDDIOIPZKCURMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-9(2)11-6-5-7-13-8-10(3,4)12/h9,11-12H,5-8H2,1-4H3.
What are the key properties of 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol?
2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol has a molecular weight of 189.30 g/mol, XLogP of 1.16, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[3-(propan-2-ylamino)propoxy]propan-2-ol is sourced from PubChem (CID 106939709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).