(3R)-3-naphthalen-1-ylmorpholine;hydrochloride

C14H16ClNO — CID 171192824

IUPAC(3R)-3-naphthalen-1-ylmorpholine;hydrochloride
SMILESCl.c1ccc2c([C@@H]3COCCN3)cccc2c1
InChIInChI=1S/C14H15NO.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)14-10-16-9-8-15-14;/h1-7,14-15H,8-10H2;1H/t14-;/m0./s1
InChIKeyNIBTYKJHQWLSHZ-UQKRIMTDSA-N
MW249.74 g/mol
LogP2.92
Rot. Bonds1

About (3R)-3-naphthalen-1-ylmorpholine;hydrochloride

(3R)-3-naphthalen-1-ylmorpholine;hydrochloride (PubChem CID 171192824) has the molecular formula C14H16ClNO and a molecular weight of 249.74 g/mol. Its IUPAC name is (3R)-3-naphthalen-1-ylmorpholine;hydrochloride.

Molecular Properties

Compound Name(3R)-3-naphthalen-1-ylmorpholine;hydrochloride
PubChem CID171192824
Molecular FormulaC14H16ClNO
Molecular Weight249.74 g/mol
Exact Mass249.09
IUPAC Name(3R)-3-naphthalen-1-ylmorpholine;hydrochloride
SMILESCl.c1ccc2c([C@@H]3COCCN3)cccc2c1
InChIInChI=1S/C14H15NO.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)14-10-16-9-8-15-14;/h1-7,14-15H,8-10H2;1H/t14-;/m0./s1
InChIKeyNIBTYKJHQWLSHZ-UQKRIMTDSA-N
XLogP2.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-naphthalen-1-ylmorpholine;hydrochloride?
The IUPAC name of (3R)-3-naphthalen-1-ylmorpholine;hydrochloride (CID 171192824) is (3R)-3-naphthalen-1-ylmorpholine;hydrochloride.
What is the SMILES notation for (3R)-3-naphthalen-1-ylmorpholine;hydrochloride?
The canonical SMILES for (3R)-3-naphthalen-1-ylmorpholine;hydrochloride is Cl.c1ccc2c([C@@H]3COCCN3)cccc2c1.
What is the InChIKey of (3R)-3-naphthalen-1-ylmorpholine;hydrochloride?
The InChIKey is NIBTYKJHQWLSHZ-UQKRIMTDSA-N. The full InChI is InChI=1S/C14H15NO.ClH/c1-2-6-12-11(4-1)5-3-7-13(12)14-10-16-9-8-15-14;/h1-7,14-15H,8-10H2;1H/t14-;/m0./s1.
What are the key properties of (3R)-3-naphthalen-1-ylmorpholine;hydrochloride?
(3R)-3-naphthalen-1-ylmorpholine;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-naphthalen-1-ylmorpholine;hydrochloride is sourced from PubChem (CID 171192824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).