2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol

C11H23NO3 — CID 64811394

IUPAC2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol
SMILESCNC(CO)(COC(C)COC)C1CC1
InChIInChI=1S/C11H23NO3/c1-9(6-14-3)15-8-11(7-13,12-2)10-4-5-10/h9-10,12-13H,4-8H2,1-3H3
InChIKeyLBLMQGWERYRATR-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.40
Rot. Bonds8

About 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol

2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol (PubChem CID 64811394) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol
PubChem CID64811394
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol
SMILESCNC(CO)(COC(C)COC)C1CC1
InChIInChI=1S/C11H23NO3/c1-9(6-14-3)15-8-11(7-13,12-2)10-4-5-10/h9-10,12-13H,4-8H2,1-3H3
InChIKeyLBLMQGWERYRATR-UHFFFAOYSA-N
XLogP0.40
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-(methylamino)-3-(2-methylpropoxy)propan-1-ol
CID 64802778
2-cyclopropyl-3-methoxy-2-(propan-2-ylamino)propan-1-ol
CID 64804918
3-[butan-2-yl(2-methoxyethyl)amino]-2-cyclopropyl-2-(methylamino)propan-1-ol
CID 64825382
2-cyclopropyl-2-(cyclopropylamino)-3-propan-2-yloxypropan-1-ol
CID 64804667
2-cyclopropyl-3-(4-methylpentan-2-yloxy)-2-(propylamino)propan-1-ol
CID 64802589
2-cyclopropyl-3-(3-methoxypropylsulfanyl)-2-(methylamino)propan-1-ol
CID 64807175
2-cyclopropyl-2-(methylamino)-3-(3-methylbutan-2-ylsulfanyl)propan-1-ol
CID 107764771
2-cyclopropyl-3-(4-methylpentoxy)-2-(propan-2-ylamino)propan-1-ol
CID 64805041
2-cyclopropyl-3-[2-(2-methylpropoxy)ethoxy]-2-(propan-2-ylamino)propan-1-ol
CID 106450690
2-cyclopropyl-2-(methylamino)-3-(2,4,6-trimethylphenoxy)propan-1-ol
CID 64809544
2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol
CID 64804840
3-[bis(3-methylbutyl)amino]-2-cyclopropyl-2-(methylamino)propan-1-ol
CID 107871619

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol (CID 64811394) is 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol is CNC(CO)(COC(C)COC)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol?
The InChIKey is LBLMQGWERYRATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-9(6-14-3)15-8-11(7-13,12-2)10-4-5-10/h9-10,12-13H,4-8H2,1-3H3.
What are the key properties of 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol?
2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol has a molecular weight of 217.31 g/mol, XLogP of 0.40, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol is sourced from PubChem (CID 64811394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).