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

C6H14N2O — CID 23368078

IUPAC[3-(methylamino)pyrrolidin-3-yl]methanol
SMILESCNC1(CO)CCNC1
InChIInChI=1S/C6H14N2O/c1-7-6(5-9)2-3-8-4-6/h7-9H,2-5H2,1H3
InChIKeyMEOOQFWJTLRGES-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.07
Rot. Bonds2

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

[3-(methylamino)pyrrolidin-3-yl]methanol (PubChem CID 23368078) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is [3-(methylamino)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(methylamino)pyrrolidin-3-yl]methanol
PubChem CID23368078
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name[3-(methylamino)pyrrolidin-3-yl]methanol
SMILESCNC1(CO)CCNC1
InChIInChI=1S/C6H14N2O/c1-7-6(5-9)2-3-8-4-6/h7-9H,2-5H2,1H3
InChIKeyMEOOQFWJTLRGES-UHFFFAOYSA-N
XLogP-1.07
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)pyrrolidin-3-yl]methanol?
The IUPAC name of [3-(methylamino)pyrrolidin-3-yl]methanol (CID 23368078) is [3-(methylamino)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-(methylamino)pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-(methylamino)pyrrolidin-3-yl]methanol is CNC1(CO)CCNC1.
What is the InChIKey of [3-(methylamino)pyrrolidin-3-yl]methanol?
The InChIKey is MEOOQFWJTLRGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-7-6(5-9)2-3-8-4-6/h7-9H,2-5H2,1H3.
What are the key properties of [3-(methylamino)pyrrolidin-3-yl]methanol?
[3-(methylamino)pyrrolidin-3-yl]methanol has a molecular weight of 130.19 g/mol, XLogP of -1.07, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 23368078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).