1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol

C10H22N2O2 — CID 63929272

IUPAC1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol
SMILESCNCC1CCN(CC(O)COC)C1
InChIInChI=1S/C10H22N2O2/c1-11-5-9-3-4-12(6-9)7-10(13)8-14-2/h9-11,13H,3-8H2,1-2H3
InChIKeyCZGXWGZEELSVKG-UHFFFAOYSA-N
MW202.30 g/mol
LogP-0.47
Rot. Bonds6

About 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol

1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol (PubChem CID 63929272) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol
PubChem CID63929272
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol
SMILESCNCC1CCN(CC(O)COC)C1
InChIInChI=1S/C10H22N2O2/c1-11-5-9-3-4-12(6-9)7-10(13)8-14-2/h9-11,13H,3-8H2,1-2H3
InChIKeyCZGXWGZEELSVKG-UHFFFAOYSA-N
XLogP-0.47
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-butoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol
CID 107264166
1-methoxy-3-[4-[(2-methylpropylamino)methyl]piperidin-1-yl]propan-2-ol
CID 63929279
1-(2-hydroxy-3-methoxypropyl)pyrrolidin-3-ol
CID 63930667
1-(3-ethylpyrrolidin-1-yl)-3-(2-methoxyethoxy)propan-2-ol
CID 106992226
1-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-3-methoxypropan-2-ol
CID 112627641
N-methyl-1-[1-(3-methyl-2-propan-2-ylbutyl)pyrrolidin-3-yl]methanamine
CID 102906426
3-[3-(methoxymethyl)pyrrolidin-1-yl]propane-1,2-diol
CID 115773044
3-methoxy-2-methyl-1-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-1-one
CID 119539844
1-[4-(2-hydroxy-3-methoxypropyl)piperazin-1-yl]-3-methoxypropan-2-ol
CID 13310876
(3S)-1-(2-hydroxy-3-methoxypropyl)piperidin-3-ol
CID 107226168
1-ethoxy-3-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]propan-2-ol
CID 63932403
N-methyl-1-[1-(2-methyl-3-methylsulfanylpropyl)pyrrolidin-3-yl]methanamine
CID 63966540

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol?
The IUPAC name of 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol (CID 63929272) is 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol is CNCC1CCN(CC(O)COC)C1.
What is the InChIKey of 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol?
The InChIKey is CZGXWGZEELSVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-11-5-9-3-4-12(6-9)7-10(13)8-14-2/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol?
1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol has a molecular weight of 202.30 g/mol, XLogP of -0.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propan-2-ol is sourced from PubChem (CID 63929272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).