[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone

C15H16N2O3 — CID 81208124

IUPAC[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone
SMILESO=C(c1cccc2cccnc12)N1CCOC(CO)C1
InChIInChI=1S/C15H16N2O3/c18-10-12-9-17(7-8-20-12)15(19)13-5-1-3-11-4-2-6-16-14(11)13/h1-6,12,18H,7-10H2
InChIKeyGCKKIJOJGHBNEW-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.07
Rot. Bonds2

About [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone

[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone (PubChem CID 81208124) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone.

Molecular Properties

Compound Name[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone
PubChem CID81208124
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone
SMILESO=C(c1cccc2cccnc12)N1CCOC(CO)C1
InChIInChI=1S/C15H16N2O3/c18-10-12-9-17(7-8-20-12)15(19)13-5-1-3-11-4-2-6-16-14(11)13/h1-6,12,18H,7-10H2
InChIKeyGCKKIJOJGHBNEW-UHFFFAOYSA-N
XLogP1.07
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(bromomethyl)morpholin-4-yl]-quinolin-8-ylmethanone
CID 81211794
(2,3-dihydroxyphenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 114344564
[2-(hydroxymethyl)morpholin-4-yl]-(1H-indol-7-yl)methanone
CID 81208687
(3-bromo-2-pyridinyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 107519186
(3-hydroxypyrrolidin-1-yl)-quinolin-8-ylmethanone
CID 62917957
(2-bromophenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81203060
2-[4-(2-methylquinoline-8-carbonyl)morpholin-2-yl]acetic acid
CID 120527700
(2-bromo-3-methylphenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 103855429
(3-methylpiperazin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119578686
[2-(hydroxymethyl)morpholin-4-yl]-(3-hydroxy-4-pyridinyl)methanone
CID 81442526
(3-hydroxypiperidin-1-yl)-quinolin-8-ylmethanone
CID 43415800
[(2S)-2-[6-(4-methoxyphenyl)-2-pyridinyl]morpholin-4-yl]-quinolin-8-ylmethanone
CID 125005581

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone?
The IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone (CID 81208124) is [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone.
What is the SMILES notation for [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone?
The canonical SMILES for [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone is O=C(c1cccc2cccnc12)N1CCOC(CO)C1.
What is the InChIKey of [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone?
The InChIKey is GCKKIJOJGHBNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c18-10-12-9-17(7-8-20-12)15(19)13-5-1-3-11-4-2-6-16-14(11)13/h1-6,12,18H,7-10H2.
What are the key properties of [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone?
[2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone has a molecular weight of 272.30 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)morpholin-4-yl]-quinolin-8-ylmethanone is sourced from PubChem (CID 81208124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).