3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride

C10H16Cl2N2O — CID 66987447

IUPAC3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride
SMILESCl.Cl.c1cncc(CO[C@@H]2CCNC2)c1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-9(6-11-4-1)8-13-10-3-5-12-7-10;;/h1-2,4,6,10,12H,3,5,7-8H2;2*1H/t10-;;/m1../s1
InChIKeyVEURXIVYDORXGM-YQFADDPSSA-N
MW251.16 g/mol
LogP1.80
Rot. Bonds3

About 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride

3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride (PubChem CID 66987447) has the molecular formula C10H16Cl2N2O and a molecular weight of 251.16 g/mol. Its IUPAC name is 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride.

Molecular Properties

Compound Name3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride
PubChem CID66987447
Molecular FormulaC10H16Cl2N2O
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC Name3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride
SMILESCl.Cl.c1cncc(CO[C@@H]2CCNC2)c1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-9(6-11-4-1)8-13-10-3-5-12-7-10;;/h1-2,4,6,10,12H,3,5,7-8H2;2*1H/t10-;;/m1../s1
InChIKeyVEURXIVYDORXGM-YQFADDPSSA-N
XLogP1.80
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(3S)-pyrrolidin-3-yl]oxymethyl]pyridine
CID 71636909
3-[(3S)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 70102226
2-[[(3S)-pyrrolidin-3-yl]oxymethyl]pyrazine;hydrochloride
CID 71636912
3-[(4-methylcyclohexyl)oxymethyl]pyridine
CID 142207375
3-[(3-bromophenyl)methoxy]pyrrolidine;hydrochloride
CID 53409416
3-[(3-chlorophenyl)methoxy]pyrrolidine;hydrochloride
CID 45075467
3-[(4-iodophenyl)methoxy]pyrrolidine;hydrochloride
CID 53409439
3-[(3-methoxyphenyl)methoxy]pyrrolidine
CID 20735282
(3R)-3-[(3-methylphenyl)methoxy]pyrrolidine
CID 26191874
(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71636735
3-piperidin-4-yloxypyridine;dihydrochloride
CID 22989727
4-(2-pyrrolidin-3-yloxyethyl)pyridine
CID 62328437

Frequently Asked Questions

What is the IUPAC name of 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride?
The IUPAC name of 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride (CID 66987447) is 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride.
What is the SMILES notation for 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride?
The canonical SMILES for 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride is Cl.Cl.c1cncc(CO[C@@H]2CCNC2)c1.
What is the InChIKey of 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride?
The InChIKey is VEURXIVYDORXGM-YQFADDPSSA-N. The full InChI is InChI=1S/C10H14N2O.2ClH/c1-2-9(6-11-4-1)8-13-10-3-5-12-7-10;;/h1-2,4,6,10,12H,3,5,7-8H2;2*1H/t10-;;/m1../s1.
What are the key properties of 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride?
3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride has a molecular weight of 251.16 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3R)-pyrrolidin-3-yl]oxymethyl]pyridine;dihydrochloride is sourced from PubChem (CID 66987447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).