1-methoxy-4-piperidin-1-ylbutan-2-ol

C10H21NO2 — CID 106246219

IUPAC1-methoxy-4-piperidin-1-ylbutan-2-ol
SMILESCOCC(O)CCN1CCCCC1
InChIInChI=1S/C10H21NO2/c1-13-9-10(12)5-8-11-6-3-2-4-7-11/h10,12H,2-9H2,1H3
InChIKeyGLLKZPPFVKZKRL-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.87
Rot. Bonds5

About 1-methoxy-4-piperidin-1-ylbutan-2-ol

1-methoxy-4-piperidin-1-ylbutan-2-ol (PubChem CID 106246219) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-methoxy-4-piperidin-1-ylbutan-2-ol.

Molecular Properties

Compound Name1-methoxy-4-piperidin-1-ylbutan-2-ol
PubChem CID106246219
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-methoxy-4-piperidin-1-ylbutan-2-ol
SMILESCOCC(O)CCN1CCCCC1
InChIInChI=1S/C10H21NO2/c1-13-9-10(12)5-8-11-6-3-2-4-7-11/h10,12H,2-9H2,1H3
InChIKeyGLLKZPPFVKZKRL-UHFFFAOYSA-N
XLogP0.87
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1,1-dioxo-1,4-thiazinan-4-yl)-1-methoxybutan-2-ol
CID 106246276
4-(2-azaspiro[3.3]heptan-2-yl)-1-methoxybutan-2-ol
CID 106246282
4-(3,3-diethylazetidin-1-yl)-1-methoxybutan-2-ol
CID 106246281
1-(2-methoxyethyl)azocane
CID 47014834
1-[4-(2-hydroxy-3-methoxypropyl)piperazin-1-yl]-3-methoxypropan-2-ol
CID 13310876
1-(azepan-1-yl)-2-[(3-hydroxy-4-methoxybutyl)amino]ethanone
CID 114163624
(3S)-1-(2-hydroxy-3-methoxypropyl)piperidin-3-ol
CID 107226168
N-[2-(azocan-1-yl)ethyl]-1-methoxypropan-2-amine
CID 62573966
3-methoxy-2-(2-piperidin-1-ylethoxy)propan-1-amine
CID 103228301
(2S)-1-piperidin-1-yl-3-[2-(2-piperidin-1-ylethoxy)ethoxy]propan-2-ol
CID 40530981
4-methoxy-3-methyl-N-(3-piperidin-1-ylpropyl)butan-1-amine
CID 113411499
3-methoxy-2-(2-pyrrolidin-1-ylethylamino)propan-1-ol
CID 106190805

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-piperidin-1-ylbutan-2-ol?
The IUPAC name of 1-methoxy-4-piperidin-1-ylbutan-2-ol (CID 106246219) is 1-methoxy-4-piperidin-1-ylbutan-2-ol.
What is the SMILES notation for 1-methoxy-4-piperidin-1-ylbutan-2-ol?
The canonical SMILES for 1-methoxy-4-piperidin-1-ylbutan-2-ol is COCC(O)CCN1CCCCC1.
What is the InChIKey of 1-methoxy-4-piperidin-1-ylbutan-2-ol?
The InChIKey is GLLKZPPFVKZKRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-13-9-10(12)5-8-11-6-3-2-4-7-11/h10,12H,2-9H2,1H3.
What are the key properties of 1-methoxy-4-piperidin-1-ylbutan-2-ol?
1-methoxy-4-piperidin-1-ylbutan-2-ol has a molecular weight of 187.28 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-piperidin-1-ylbutan-2-ol is sourced from PubChem (CID 106246219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).