(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone

C21H20N2O4 — CID 95555607

IUPAC(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
SMILESCOc1ccc2cc([C@@H]3CN(C(=O)c4ccc(O)cn4)CCO3)ccc2c1
InChIInChI=1S/C21H20N2O4/c1-26-18-6-4-14-10-16(3-2-15(14)11-18)20-13-23(8-9-27-20)21(25)19-7-5-17(24)12-22-19/h2-7,10-12,20,24H,8-9,13H2,1H3/t20-/m0/s1
InChIKeyHHTZJJRRXLMPAS-FQEVSTJZSA-N
MW364.40 g/mol
LogP3.16
Rot. Bonds3

About (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone

(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone (PubChem CID 95555607) has the molecular formula C21H20N2O4 and a molecular weight of 364.40 g/mol. Its IUPAC name is (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
PubChem CID95555607
Molecular FormulaC21H20N2O4
Molecular Weight364.40 g/mol
Exact Mass364.14
IUPAC Name(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
SMILESCOc1ccc2cc([C@@H]3CN(C(=O)c4ccc(O)cn4)CCO3)ccc2c1
InChIInChI=1S/C21H20N2O4/c1-26-18-6-4-14-10-16(3-2-15(14)11-18)20-13-23(8-9-27-20)21(25)19-7-5-17(24)12-22-19/h2-7,10-12,20,24H,8-9,13H2,1H3/t20-/m0/s1
InChIKeyHHTZJJRRXLMPAS-FQEVSTJZSA-N
XLogP3.16
TPSA71.89 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The IUPAC name of (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone (CID 95555607) is (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The canonical SMILES for (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone is COc1ccc2cc([C@@H]3CN(C(=O)c4ccc(O)cn4)CCO3)ccc2c1.
What is the InChIKey of (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The InChIKey is HHTZJJRRXLMPAS-FQEVSTJZSA-N. The full InChI is InChI=1S/C21H20N2O4/c1-26-18-6-4-14-10-16(3-2-15(14)11-18)20-13-23(8-9-27-20)21(25)19-7-5-17(24)12-22-19/h2-7,10-12,20,24H,8-9,13H2,1H3/t20-/m0/s1.
What are the key properties of (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone has a molecular weight of 364.40 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 95555607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).