3-(pyridin-2-ylmethyl)morpholine;dihydrochloride

C10H16Cl2N2O — CID 155820202

IUPAC3-(pyridin-2-ylmethyl)morpholine;dihydrochloride
SMILESCl.Cl.c1ccc(CC2COCCN2)nc1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-4-11-9(3-1)7-10-8-13-6-5-12-10;;/h1-4,10,12H,5-8H2;2*1H
InChIKeyCWLARGHLLNNAFG-UHFFFAOYSA-N
MW251.16 g/mol
LogP1.46
Rot. Bonds2

About 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride

3-(pyridin-2-ylmethyl)morpholine;dihydrochloride (PubChem CID 155820202) has the molecular formula C10H16Cl2N2O and a molecular weight of 251.16 g/mol. Its IUPAC name is 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride.

Molecular Properties

Compound Name3-(pyridin-2-ylmethyl)morpholine;dihydrochloride
PubChem CID155820202
Molecular FormulaC10H16Cl2N2O
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC Name3-(pyridin-2-ylmethyl)morpholine;dihydrochloride
SMILESCl.Cl.c1ccc(CC2COCCN2)nc1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-4-11-9(3-1)7-10-8-13-6-5-12-10;;/h1-4,10,12H,5-8H2;2*1H
InChIKeyCWLARGHLLNNAFG-UHFFFAOYSA-N
XLogP1.46
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride?
The IUPAC name of 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride (CID 155820202) is 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride.
What is the SMILES notation for 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride?
The canonical SMILES for 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride is Cl.Cl.c1ccc(CC2COCCN2)nc1.
What is the InChIKey of 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride?
The InChIKey is CWLARGHLLNNAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.2ClH/c1-2-4-11-9(3-1)7-10-8-13-6-5-12-10;;/h1-4,10,12H,5-8H2;2*1H.
What are the key properties of 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride?
3-(pyridin-2-ylmethyl)morpholine;dihydrochloride has a molecular weight of 251.16 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyridin-2-ylmethyl)morpholine;dihydrochloride is sourced from PubChem (CID 155820202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).