[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol

C7H16N2O — CID 62975688

IUPAC[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol
SMILESCNC1(CO)CCN(C)C1
InChIInChI=1S/C7H16N2O/c1-8-7(6-10)3-4-9(2)5-7/h8,10H,3-6H2,1-2H3
InChIKeyUBYFLVGINDLCFX-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.73
Rot. Bonds2

About [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol

[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol (PubChem CID 62975688) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol
PubChem CID62975688
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol
SMILESCNC1(CO)CCN(C)C1
InChIInChI=1S/C7H16N2O/c1-8-7(6-10)3-4-9(2)5-7/h8,10H,3-6H2,1-2H3
InChIKeyUBYFLVGINDLCFX-UHFFFAOYSA-N
XLogP-0.73
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol (CID 62975688) is [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol is CNC1(CO)CCN(C)C1.
What is the InChIKey of [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol?
The InChIKey is UBYFLVGINDLCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-8-7(6-10)3-4-9(2)5-7/h8,10H,3-6H2,1-2H3.
What are the key properties of [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol?
[1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol has a molecular weight of 144.22 g/mol, XLogP of -0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methyl-3-(methylamino)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 62975688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).