potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate

C9H16KNO — CID 166533358

IUPACpotassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate
SMILES[K+].[O-]CC1(CN2CCCC2)CC1
InChIInChI=1S/C9H16NO.K/c11-8-9(3-4-9)7-10-5-1-2-6-10;/h1-8H2;/q-1;+1
InChIKeyPCIOPCJBJIFYNM-UHFFFAOYSA-N
MW193.33 g/mol
LogP-2.77
Rot. Bonds3

About potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate

potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate (PubChem CID 166533358) has the molecular formula C9H16KNO and a molecular weight of 193.33 g/mol. Its IUPAC name is potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate.

Molecular Properties

Compound Namepotassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate
PubChem CID166533358
Molecular FormulaC9H16KNO
Molecular Weight193.33 g/mol
Exact Mass193.09
IUPAC Namepotassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate
SMILES[K+].[O-]CC1(CN2CCCC2)CC1
InChIInChI=1S/C9H16NO.K/c11-8-9(3-4-9)7-10-5-1-2-6-10;/h1-8H2;/q-1;+1
InChIKeyPCIOPCJBJIFYNM-UHFFFAOYSA-N
XLogP-2.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 5-2.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1-((Pyrrolidin-1-yl)methyl)cyclopropyl)methanol
CID 66854227
[1-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]cyclopropyl]methyl hypoiodite
CID 156062080
3-Fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 164878349
[1-(Pyrrolidin-1-ylmethyl)cyclopropyl]methyl hypofluorite
CID 164878789
1-[[1-(Ethoxymethyl)cyclopropyl]methyl]-3-fluoropyrrolidine
CID 164904090
[1-[(3-Fluoropyrrolidin-1-yl)methyl]cyclopropyl]methyl hypoiodite
CID 164904219
[1-[(3-Fluoropyrrolidin-1-yl)methyl]cyclopropyl]methyl hypofluorite
CID 166533176
(3R)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 167190956
(3S)-3-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 167254755
3-Fluoro-1-[[1-(propoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 169572965
3,4-Difluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 170601618
Potassium;[1-[(3,3-difluoropyrrolidin-1-yl)methyl]cyclopropyl]methanolate;ethane
CID 172328587

Frequently Asked Questions

What is the IUPAC name of potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate?
The IUPAC name of potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate (CID 166533358) is potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate.
What is the SMILES notation for potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate?
The canonical SMILES for potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate is [K+].[O-]CC1(CN2CCCC2)CC1.
What is the InChIKey of potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate?
The InChIKey is PCIOPCJBJIFYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16NO.K/c11-8-9(3-4-9)7-10-5-1-2-6-10;/h1-8H2;/q-1;+1.
What are the key properties of potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate?
potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate has a molecular weight of 193.33 g/mol, XLogP of -2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate is sourced from PubChem (CID 166533358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).