2-methyl-2-(methylamino)-4-propoxypentan-1-ol

C10H23NO2 — CID 64808553

IUPAC2-methyl-2-(methylamino)-4-propoxypentan-1-ol
SMILESCCCOC(C)CC(C)(CO)NC
InChIInChI=1S/C10H23NO2/c1-5-6-13-9(2)7-10(3,8-12)11-4/h9,11-12H,5-8H2,1-4H3
InChIKeyXPZAHLAMZIEILI-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.16
Rot. Bonds7

About 2-methyl-2-(methylamino)-4-propoxypentan-1-ol

2-methyl-2-(methylamino)-4-propoxypentan-1-ol (PubChem CID 64808553) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-4-propoxypentan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-4-propoxypentan-1-ol
PubChem CID64808553
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name2-methyl-2-(methylamino)-4-propoxypentan-1-ol
SMILESCCCOC(C)CC(C)(CO)NC
InChIInChI=1S/C10H23NO2/c1-5-6-13-9(2)7-10(3,8-12)11-4/h9,11-12H,5-8H2,1-4H3
InChIKeyXPZAHLAMZIEILI-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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-4-propoxypentan-1-ol?
The IUPAC name of 2-methyl-2-(methylamino)-4-propoxypentan-1-ol (CID 64808553) is 2-methyl-2-(methylamino)-4-propoxypentan-1-ol.
What is the SMILES notation for 2-methyl-2-(methylamino)-4-propoxypentan-1-ol?
The canonical SMILES for 2-methyl-2-(methylamino)-4-propoxypentan-1-ol is CCCOC(C)CC(C)(CO)NC.
What is the InChIKey of 2-methyl-2-(methylamino)-4-propoxypentan-1-ol?
The InChIKey is XPZAHLAMZIEILI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-5-6-13-9(2)7-10(3,8-12)11-4/h9,11-12H,5-8H2,1-4H3.
What are the key properties of 2-methyl-2-(methylamino)-4-propoxypentan-1-ol?
2-methyl-2-(methylamino)-4-propoxypentan-1-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-2-(methylamino)-4-propoxypentan-1-ol is sourced from PubChem (CID 64808553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).