(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine

C26H25N3O2 — CID 125021519

IUPAC(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine
SMILESCOc1ccc(-c2cccc([C@@H]3CN(Cc4ccc5ncccc5c4)CCO3)n2)cc1
InChIInChI=1S/C26H25N3O2/c1-30-22-10-8-20(9-11-22)24-5-2-6-25(28-24)26-18-29(14-15-31-26)17-19-7-12-23-21(16-19)4-3-13-27-23/h2-13,16,26H,14-15,17-18H2,1H3/t26-/m0/s1
InChIKeyYKFYGVWHRQWPQJ-SANMLTNESA-N
MW411.51 g/mol
LogP4.88
Rot. Bonds5

About (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine

(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine (PubChem CID 125021519) has the molecular formula C26H25N3O2 and a molecular weight of 411.51 g/mol. Its IUPAC name is (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine.

Molecular Properties

Compound Name(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine
PubChem CID125021519
Molecular FormulaC26H25N3O2
Molecular Weight411.51 g/mol
Exact Mass411.19
IUPAC Name(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine
SMILESCOc1ccc(-c2cccc([C@@H]3CN(Cc4ccc5ncccc5c4)CCO3)n2)cc1
InChIInChI=1S/C26H25N3O2/c1-30-22-10-8-20(9-11-22)24-5-2-6-25(28-24)26-18-29(14-15-31-26)17-19-7-12-23-21(16-19)4-3-13-27-23/h2-13,16,26H,14-15,17-18H2,1H3/t26-/m0/s1
InChIKeyYKFYGVWHRQWPQJ-SANMLTNESA-N
XLogP4.88
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.51
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124975171
2-(2,6-dimethylpyrimidin-4-yl)-4-(quinolin-6-ylmethyl)morpholine
CID 110115969
(2S)-4-[(1-ethylpyrazol-4-yl)methyl]-2-[6-(4-methoxyphenyl)-2-pyridinyl]morpholine
CID 124977152
2-[6-(4-methoxyphenyl)pyrazin-2-yl]-4-(quinolin-5-ylmethyl)morpholine
CID 127251047
3-[4-(quinolin-6-ylmethyl)morpholin-2-yl]pyrazin-2-amine
CID 110112796
2-methyl-4-[(2S)-4-(quinolin-6-ylmethyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 137168485
2-[5-(2-phenoxyethyl)-1H-pyrazol-3-yl]-4-(quinolin-6-ylmethyl)morpholine
CID 132771953
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-(quinolin-6-ylmethyl)morpholin-2-yl]pyridin-2-amine
CID 124953524
4-[(1,3-dimethylpyrazol-4-yl)methyl]-2-[6-(4-methoxyphenyl)-2-pyridinyl]morpholine
CID 127250503
2-[5-[2-(3-fluorophenoxy)ethyl]-1-methylpyrazol-3-yl]-4-(quinolin-6-ylmethyl)morpholine
CID 127248576
N,N-dimethyl-1-[2-[4-(quinolin-6-ylmethyl)morpholin-2-yl]-1H-imidazol-5-yl]methanamine
CID 110117068
N'-hydroxy-4-(quinolin-6-ylmethyl)morpholine-2-carboximidamide
CID 79670544

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine?
The IUPAC name of (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine (CID 125021519) is (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine.
What is the SMILES notation for (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine?
The canonical SMILES for (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine is COc1ccc(-c2cccc([C@@H]3CN(Cc4ccc5ncccc5c4)CCO3)n2)cc1.
What is the InChIKey of (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine?
The InChIKey is YKFYGVWHRQWPQJ-SANMLTNESA-N. The full InChI is InChI=1S/C26H25N3O2/c1-30-22-10-8-20(9-11-22)24-5-2-6-25(28-24)26-18-29(14-15-31-26)17-19-7-12-23-21(16-19)4-3-13-27-23/h2-13,16,26H,14-15,17-18H2,1H3/t26-/m0/s1.
What are the key properties of (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine?
(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine has a molecular weight of 411.51 g/mol, XLogP of 4.88, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]-4-(quinolin-6-ylmethyl)morpholine is sourced from PubChem (CID 125021519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).