(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone

C12H16N2O3 — CID 55257874

IUPAC(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone
SMILESCCC1COCCN1C(=O)c1cncc(O)c1
InChIInChI=1S/C12H16N2O3/c1-2-10-8-17-4-3-14(10)12(16)9-5-11(15)7-13-6-9/h5-7,10,15H,2-4,8H2,1H3
InChIKeyBGPOFMVSMAWFFF-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.04
Rot. Bonds2

About (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone

(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone (PubChem CID 55257874) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone.

Molecular Properties

Compound Name(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone
PubChem CID55257874
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone
SMILESCCC1COCCN1C(=O)c1cncc(O)c1
InChIInChI=1S/C12H16N2O3/c1-2-10-8-17-4-3-14(10)12(16)9-5-11(15)7-13-6-9/h5-7,10,15H,2-4,8H2,1H3
InChIKeyBGPOFMVSMAWFFF-UHFFFAOYSA-N
XLogP1.04
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(6-bromo-3-pyridinyl)-(3-ethylmorpholin-4-yl)methanone
CID 66464852
(3-chloro-4-hydroxyphenyl)-(3-ethylmorpholin-4-yl)methanone
CID 43613528
(3-ethylmorpholin-4-yl)-(5-iodothiophen-3-yl)methanone
CID 78966403
(5-hydroxy-3-pyridinyl)-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 128991419
(2-chloro-6-ethyl-4-pyridinyl)-(3-ethylmorpholin-4-yl)methanone
CID 113379780
[(3S)-3-ethylmorpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 70772603
[4-(aminomethyl)phenyl]-(3-ethylmorpholin-4-yl)methanone
CID 43611605
(3-ethylmorpholin-4-yl)-(1,2,3,4-tetrahydroquinoxalin-6-yl)methanone
CID 104614640
[4-(ethylamino)-3,5-difluorophenyl]-(3-ethylmorpholin-4-yl)methanone
CID 63185055
[2-(aminomethyl)pyrrolidin-1-yl]-(5-hydroxy-3-pyridinyl)methanone
CID 115312082
5-hydroxy-N-[[1-(5-hydroxypyridine-3-carbonyl)azetidin-2-yl]methyl]-N-methylpyridine-3-carboxamide
CID 167743733
(3-ethylmorpholin-4-yl)-[3-(3-hydroxyprop-1-ynyl)-5-methylphenyl]methanone
CID 115999932

Frequently Asked Questions

What is the IUPAC name of (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone?
The IUPAC name of (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone (CID 55257874) is (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone.
What is the SMILES notation for (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone?
The canonical SMILES for (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone is CCC1COCCN1C(=O)c1cncc(O)c1.
What is the InChIKey of (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone?
The InChIKey is BGPOFMVSMAWFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-2-10-8-17-4-3-14(10)12(16)9-5-11(15)7-13-6-9/h5-7,10,15H,2-4,8H2,1H3.
What are the key properties of (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone?
(3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone has a molecular weight of 236.27 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylmorpholin-4-yl)-(5-hydroxy-3-pyridinyl)methanone is sourced from PubChem (CID 55257874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).